Solvent Effect and Preferential Solvation Analysis of Isophthalic Acid Solubility in Acetone (1) + Water (2) and Acetic Acid (1) + Water (2) Mixtures
Abstract Data on solubility of isophthalic acid in acetone (1) + water (2) and acetic acid (1) + water (2) mixtures over the full composition range were used to analyze solvent effect by using linear solvation energy relationships approach considering Kamlet, Abboud, and Taft parameters as solvent d...
Ausführliche Beschreibung
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| Autor*in: |
Ghalandari, Ali [verfasserIn] |
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| Format: |
E-Artikel |
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| Sprache: |
Englisch |
| Erschienen: |
2022 |
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| Schlagwörter: |
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| Anmerkung: |
© The Author(s), under exclusive licence to Springer Science+Business Media, LLC, part of Springer Nature 2022 |
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| Übergeordnetes Werk: |
Enthalten in: Journal of solution chemistry - New York, NY [u.a.] : Springer Science + Business Media B.V., 1972, 51(2022), 9 vom: 30. Juni, Seite 1148-1161 |
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| Übergeordnetes Werk: |
volume:51 ; year:2022 ; number:9 ; day:30 ; month:06 ; pages:1148-1161 |
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| DOI / URN: |
10.1007/s10953-022-01178-8 |
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SPR047847999 |
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| 520 | |a Abstract Data on solubility of isophthalic acid in acetone (1) + water (2) and acetic acid (1) + water (2) mixtures over the full composition range were used to analyze solvent effect by using linear solvation energy relationships approach considering Kamlet, Abboud, and Taft parameters as solvent descriptors to provide detail information on the solute–solvent and solvent–solvent interactions. Solvent effect analysis revealed which types of interactions were the main essential characteristics of solvent mixtures for solubility variation. Results indicate that cavity term and hydrogen bonding interactions were the main contributors to solvent effect on solubility in aqueous mixtures studied here. The inverse Kirkwood–Buff integral method was used to determine and analyze the possibility of preferential solvation of isophthalic acid by each of solvents in aqueous binary mixtures. The local mole fraction of acetone and acetic acid in solvation shell of isophthalic acid was determined as a function of bulk mole fraction of solvents over the full composition range in binary mixtures. The extent of preferential solvation was discussed by considering the characteristics of isophthalic acid and pure solvents and their possible mutual interactions. In addition, COSMO-RS computation was used for qualitative analysis of intermolecular interactions. | ||
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10.1007/s10953-022-01178-8 doi (DE-627)SPR047847999 (SPR)s10953-022-01178-8-e DE-627 ger DE-627 rakwb eng Ghalandari, Ali verfasserin aut Solvent Effect and Preferential Solvation Analysis of Isophthalic Acid Solubility in Acetone (1) + Water (2) and Acetic Acid (1) + Water (2) Mixtures 2022 Text txt rdacontent Computermedien c rdamedia Online-Ressource cr rdacarrier © The Author(s), under exclusive licence to Springer Science+Business Media, LLC, part of Springer Nature 2022 Abstract Data on solubility of isophthalic acid in acetone (1) + water (2) and acetic acid (1) + water (2) mixtures over the full composition range were used to analyze solvent effect by using linear solvation energy relationships approach considering Kamlet, Abboud, and Taft parameters as solvent descriptors to provide detail information on the solute–solvent and solvent–solvent interactions. Solvent effect analysis revealed which types of interactions were the main essential characteristics of solvent mixtures for solubility variation. Results indicate that cavity term and hydrogen bonding interactions were the main contributors to solvent effect on solubility in aqueous mixtures studied here. The inverse Kirkwood–Buff integral method was used to determine and analyze the possibility of preferential solvation of isophthalic acid by each of solvents in aqueous binary mixtures. The local mole fraction of acetone and acetic acid in solvation shell of isophthalic acid was determined as a function of bulk mole fraction of solvents over the full composition range in binary mixtures. The extent of preferential solvation was discussed by considering the characteristics of isophthalic acid and pure solvents and their possible mutual interactions. In addition, COSMO-RS computation was used for qualitative analysis of intermolecular interactions. Isophthalic acid (dpeaa)DE-He213 Solubility (dpeaa)DE-He213 Solvent effect (dpeaa)DE-He213 Preferential solvation (dpeaa)DE-He213 Local composition (dpeaa)DE-He213 Saadati, Zohreh aut Goodajdar, Bijan Mombeni aut Farajtabar, Ali (orcid)0000-0002-5510-3782 aut Enthalten in Journal of solution chemistry New York, NY [u.a.] : Springer Science + Business Media B.V., 1972 51(2022), 9 vom: 30. Juni, Seite 1148-1161 (DE-627)317881876 (DE-600)2017287-4 1572-8927 nnns volume:51 year:2022 number:9 day:30 month:06 pages:1148-1161 https://dx.doi.org/10.1007/s10953-022-01178-8 lizenzpflichtig Volltext GBV_USEFLAG_A SYSFLAG_A GBV_SPRINGER SSG-OLC-PHA GBV_ILN_11 GBV_ILN_20 GBV_ILN_22 GBV_ILN_23 GBV_ILN_24 GBV_ILN_31 GBV_ILN_32 GBV_ILN_39 GBV_ILN_40 GBV_ILN_60 GBV_ILN_62 GBV_ILN_63 GBV_ILN_69 GBV_ILN_70 GBV_ILN_73 GBV_ILN_74 GBV_ILN_90 GBV_ILN_95 GBV_ILN_100 GBV_ILN_101 GBV_ILN_105 GBV_ILN_110 GBV_ILN_120 GBV_ILN_138 GBV_ILN_150 GBV_ILN_151 GBV_ILN_152 GBV_ILN_161 GBV_ILN_170 GBV_ILN_171 GBV_ILN_187 GBV_ILN_213 GBV_ILN_224 GBV_ILN_230 GBV_ILN_250 GBV_ILN_281 GBV_ILN_285 GBV_ILN_293 GBV_ILN_370 GBV_ILN_602 GBV_ILN_636 GBV_ILN_702 GBV_ILN_2001 GBV_ILN_2003 GBV_ILN_2004 GBV_ILN_2005 GBV_ILN_2006 GBV_ILN_2007 GBV_ILN_2008 GBV_ILN_2009 GBV_ILN_2010 GBV_ILN_2011 GBV_ILN_2014 GBV_ILN_2015 GBV_ILN_2020 GBV_ILN_2021 GBV_ILN_2025 GBV_ILN_2026 GBV_ILN_2027 GBV_ILN_2031 GBV_ILN_2034 GBV_ILN_2037 GBV_ILN_2038 GBV_ILN_2039 GBV_ILN_2044 GBV_ILN_2048 GBV_ILN_2049 GBV_ILN_2050 GBV_ILN_2055 GBV_ILN_2056 GBV_ILN_2057 GBV_ILN_2059 GBV_ILN_2061 GBV_ILN_2064 GBV_ILN_2065 GBV_ILN_2068 GBV_ILN_2088 GBV_ILN_2093 GBV_ILN_2106 GBV_ILN_2107 GBV_ILN_2108 GBV_ILN_2110 GBV_ILN_2111 GBV_ILN_2112 GBV_ILN_2113 GBV_ILN_2118 GBV_ILN_2122 GBV_ILN_2129 GBV_ILN_2143 GBV_ILN_2144 GBV_ILN_2147 GBV_ILN_2148 GBV_ILN_2152 GBV_ILN_2153 GBV_ILN_2188 GBV_ILN_2190 GBV_ILN_2232 GBV_ILN_2336 GBV_ILN_2446 GBV_ILN_2470 GBV_ILN_2472 GBV_ILN_2507 GBV_ILN_2522 GBV_ILN_2548 GBV_ILN_4035 GBV_ILN_4037 GBV_ILN_4046 GBV_ILN_4112 GBV_ILN_4125 GBV_ILN_4126 GBV_ILN_4242 GBV_ILN_4246 GBV_ILN_4249 GBV_ILN_4251 GBV_ILN_4305 GBV_ILN_4306 GBV_ILN_4307 GBV_ILN_4313 GBV_ILN_4322 GBV_ILN_4323 GBV_ILN_4324 GBV_ILN_4325 GBV_ILN_4326 GBV_ILN_4328 GBV_ILN_4333 GBV_ILN_4334 GBV_ILN_4335 GBV_ILN_4336 GBV_ILN_4338 GBV_ILN_4393 GBV_ILN_4700 AR 51 2022 9 30 06 1148-1161 |
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10.1007/s10953-022-01178-8 doi (DE-627)SPR047847999 (SPR)s10953-022-01178-8-e DE-627 ger DE-627 rakwb eng Ghalandari, Ali verfasserin aut Solvent Effect and Preferential Solvation Analysis of Isophthalic Acid Solubility in Acetone (1) + Water (2) and Acetic Acid (1) + Water (2) Mixtures 2022 Text txt rdacontent Computermedien c rdamedia Online-Ressource cr rdacarrier © The Author(s), under exclusive licence to Springer Science+Business Media, LLC, part of Springer Nature 2022 Abstract Data on solubility of isophthalic acid in acetone (1) + water (2) and acetic acid (1) + water (2) mixtures over the full composition range were used to analyze solvent effect by using linear solvation energy relationships approach considering Kamlet, Abboud, and Taft parameters as solvent descriptors to provide detail information on the solute–solvent and solvent–solvent interactions. Solvent effect analysis revealed which types of interactions were the main essential characteristics of solvent mixtures for solubility variation. Results indicate that cavity term and hydrogen bonding interactions were the main contributors to solvent effect on solubility in aqueous mixtures studied here. The inverse Kirkwood–Buff integral method was used to determine and analyze the possibility of preferential solvation of isophthalic acid by each of solvents in aqueous binary mixtures. The local mole fraction of acetone and acetic acid in solvation shell of isophthalic acid was determined as a function of bulk mole fraction of solvents over the full composition range in binary mixtures. The extent of preferential solvation was discussed by considering the characteristics of isophthalic acid and pure solvents and their possible mutual interactions. In addition, COSMO-RS computation was used for qualitative analysis of intermolecular interactions. Isophthalic acid (dpeaa)DE-He213 Solubility (dpeaa)DE-He213 Solvent effect (dpeaa)DE-He213 Preferential solvation (dpeaa)DE-He213 Local composition (dpeaa)DE-He213 Saadati, Zohreh aut Goodajdar, Bijan Mombeni aut Farajtabar, Ali (orcid)0000-0002-5510-3782 aut Enthalten in Journal of solution chemistry New York, NY [u.a.] : Springer Science + Business Media B.V., 1972 51(2022), 9 vom: 30. Juni, Seite 1148-1161 (DE-627)317881876 (DE-600)2017287-4 1572-8927 nnns volume:51 year:2022 number:9 day:30 month:06 pages:1148-1161 https://dx.doi.org/10.1007/s10953-022-01178-8 lizenzpflichtig Volltext GBV_USEFLAG_A SYSFLAG_A GBV_SPRINGER SSG-OLC-PHA GBV_ILN_11 GBV_ILN_20 GBV_ILN_22 GBV_ILN_23 GBV_ILN_24 GBV_ILN_31 GBV_ILN_32 GBV_ILN_39 GBV_ILN_40 GBV_ILN_60 GBV_ILN_62 GBV_ILN_63 GBV_ILN_69 GBV_ILN_70 GBV_ILN_73 GBV_ILN_74 GBV_ILN_90 GBV_ILN_95 GBV_ILN_100 GBV_ILN_101 GBV_ILN_105 GBV_ILN_110 GBV_ILN_120 GBV_ILN_138 GBV_ILN_150 GBV_ILN_151 GBV_ILN_152 GBV_ILN_161 GBV_ILN_170 GBV_ILN_171 GBV_ILN_187 GBV_ILN_213 GBV_ILN_224 GBV_ILN_230 GBV_ILN_250 GBV_ILN_281 GBV_ILN_285 GBV_ILN_293 GBV_ILN_370 GBV_ILN_602 GBV_ILN_636 GBV_ILN_702 GBV_ILN_2001 GBV_ILN_2003 GBV_ILN_2004 GBV_ILN_2005 GBV_ILN_2006 GBV_ILN_2007 GBV_ILN_2008 GBV_ILN_2009 GBV_ILN_2010 GBV_ILN_2011 GBV_ILN_2014 GBV_ILN_2015 GBV_ILN_2020 GBV_ILN_2021 GBV_ILN_2025 GBV_ILN_2026 GBV_ILN_2027 GBV_ILN_2031 GBV_ILN_2034 GBV_ILN_2037 GBV_ILN_2038 GBV_ILN_2039 GBV_ILN_2044 GBV_ILN_2048 GBV_ILN_2049 GBV_ILN_2050 GBV_ILN_2055 GBV_ILN_2056 GBV_ILN_2057 GBV_ILN_2059 GBV_ILN_2061 GBV_ILN_2064 GBV_ILN_2065 GBV_ILN_2068 GBV_ILN_2088 GBV_ILN_2093 GBV_ILN_2106 GBV_ILN_2107 GBV_ILN_2108 GBV_ILN_2110 GBV_ILN_2111 GBV_ILN_2112 GBV_ILN_2113 GBV_ILN_2118 GBV_ILN_2122 GBV_ILN_2129 GBV_ILN_2143 GBV_ILN_2144 GBV_ILN_2147 GBV_ILN_2148 GBV_ILN_2152 GBV_ILN_2153 GBV_ILN_2188 GBV_ILN_2190 GBV_ILN_2232 GBV_ILN_2336 GBV_ILN_2446 GBV_ILN_2470 GBV_ILN_2472 GBV_ILN_2507 GBV_ILN_2522 GBV_ILN_2548 GBV_ILN_4035 GBV_ILN_4037 GBV_ILN_4046 GBV_ILN_4112 GBV_ILN_4125 GBV_ILN_4126 GBV_ILN_4242 GBV_ILN_4246 GBV_ILN_4249 GBV_ILN_4251 GBV_ILN_4305 GBV_ILN_4306 GBV_ILN_4307 GBV_ILN_4313 GBV_ILN_4322 GBV_ILN_4323 GBV_ILN_4324 GBV_ILN_4325 GBV_ILN_4326 GBV_ILN_4328 GBV_ILN_4333 GBV_ILN_4334 GBV_ILN_4335 GBV_ILN_4336 GBV_ILN_4338 GBV_ILN_4393 GBV_ILN_4700 AR 51 2022 9 30 06 1148-1161 |
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10.1007/s10953-022-01178-8 doi (DE-627)SPR047847999 (SPR)s10953-022-01178-8-e DE-627 ger DE-627 rakwb eng Ghalandari, Ali verfasserin aut Solvent Effect and Preferential Solvation Analysis of Isophthalic Acid Solubility in Acetone (1) + Water (2) and Acetic Acid (1) + Water (2) Mixtures 2022 Text txt rdacontent Computermedien c rdamedia Online-Ressource cr rdacarrier © The Author(s), under exclusive licence to Springer Science+Business Media, LLC, part of Springer Nature 2022 Abstract Data on solubility of isophthalic acid in acetone (1) + water (2) and acetic acid (1) + water (2) mixtures over the full composition range were used to analyze solvent effect by using linear solvation energy relationships approach considering Kamlet, Abboud, and Taft parameters as solvent descriptors to provide detail information on the solute–solvent and solvent–solvent interactions. Solvent effect analysis revealed which types of interactions were the main essential characteristics of solvent mixtures for solubility variation. Results indicate that cavity term and hydrogen bonding interactions were the main contributors to solvent effect on solubility in aqueous mixtures studied here. The inverse Kirkwood–Buff integral method was used to determine and analyze the possibility of preferential solvation of isophthalic acid by each of solvents in aqueous binary mixtures. The local mole fraction of acetone and acetic acid in solvation shell of isophthalic acid was determined as a function of bulk mole fraction of solvents over the full composition range in binary mixtures. The extent of preferential solvation was discussed by considering the characteristics of isophthalic acid and pure solvents and their possible mutual interactions. In addition, COSMO-RS computation was used for qualitative analysis of intermolecular interactions. Isophthalic acid (dpeaa)DE-He213 Solubility (dpeaa)DE-He213 Solvent effect (dpeaa)DE-He213 Preferential solvation (dpeaa)DE-He213 Local composition (dpeaa)DE-He213 Saadati, Zohreh aut Goodajdar, Bijan Mombeni aut Farajtabar, Ali (orcid)0000-0002-5510-3782 aut Enthalten in Journal of solution chemistry New York, NY [u.a.] : Springer Science + Business Media B.V., 1972 51(2022), 9 vom: 30. Juni, Seite 1148-1161 (DE-627)317881876 (DE-600)2017287-4 1572-8927 nnns volume:51 year:2022 number:9 day:30 month:06 pages:1148-1161 https://dx.doi.org/10.1007/s10953-022-01178-8 lizenzpflichtig Volltext GBV_USEFLAG_A SYSFLAG_A GBV_SPRINGER SSG-OLC-PHA GBV_ILN_11 GBV_ILN_20 GBV_ILN_22 GBV_ILN_23 GBV_ILN_24 GBV_ILN_31 GBV_ILN_32 GBV_ILN_39 GBV_ILN_40 GBV_ILN_60 GBV_ILN_62 GBV_ILN_63 GBV_ILN_69 GBV_ILN_70 GBV_ILN_73 GBV_ILN_74 GBV_ILN_90 GBV_ILN_95 GBV_ILN_100 GBV_ILN_101 GBV_ILN_105 GBV_ILN_110 GBV_ILN_120 GBV_ILN_138 GBV_ILN_150 GBV_ILN_151 GBV_ILN_152 GBV_ILN_161 GBV_ILN_170 GBV_ILN_171 GBV_ILN_187 GBV_ILN_213 GBV_ILN_224 GBV_ILN_230 GBV_ILN_250 GBV_ILN_281 GBV_ILN_285 GBV_ILN_293 GBV_ILN_370 GBV_ILN_602 GBV_ILN_636 GBV_ILN_702 GBV_ILN_2001 GBV_ILN_2003 GBV_ILN_2004 GBV_ILN_2005 GBV_ILN_2006 GBV_ILN_2007 GBV_ILN_2008 GBV_ILN_2009 GBV_ILN_2010 GBV_ILN_2011 GBV_ILN_2014 GBV_ILN_2015 GBV_ILN_2020 GBV_ILN_2021 GBV_ILN_2025 GBV_ILN_2026 GBV_ILN_2027 GBV_ILN_2031 GBV_ILN_2034 GBV_ILN_2037 GBV_ILN_2038 GBV_ILN_2039 GBV_ILN_2044 GBV_ILN_2048 GBV_ILN_2049 GBV_ILN_2050 GBV_ILN_2055 GBV_ILN_2056 GBV_ILN_2057 GBV_ILN_2059 GBV_ILN_2061 GBV_ILN_2064 GBV_ILN_2065 GBV_ILN_2068 GBV_ILN_2088 GBV_ILN_2093 GBV_ILN_2106 GBV_ILN_2107 GBV_ILN_2108 GBV_ILN_2110 GBV_ILN_2111 GBV_ILN_2112 GBV_ILN_2113 GBV_ILN_2118 GBV_ILN_2122 GBV_ILN_2129 GBV_ILN_2143 GBV_ILN_2144 GBV_ILN_2147 GBV_ILN_2148 GBV_ILN_2152 GBV_ILN_2153 GBV_ILN_2188 GBV_ILN_2190 GBV_ILN_2232 GBV_ILN_2336 GBV_ILN_2446 GBV_ILN_2470 GBV_ILN_2472 GBV_ILN_2507 GBV_ILN_2522 GBV_ILN_2548 GBV_ILN_4035 GBV_ILN_4037 GBV_ILN_4046 GBV_ILN_4112 GBV_ILN_4125 GBV_ILN_4126 GBV_ILN_4242 GBV_ILN_4246 GBV_ILN_4249 GBV_ILN_4251 GBV_ILN_4305 GBV_ILN_4306 GBV_ILN_4307 GBV_ILN_4313 GBV_ILN_4322 GBV_ILN_4323 GBV_ILN_4324 GBV_ILN_4325 GBV_ILN_4326 GBV_ILN_4328 GBV_ILN_4333 GBV_ILN_4334 GBV_ILN_4335 GBV_ILN_4336 GBV_ILN_4338 GBV_ILN_4393 GBV_ILN_4700 AR 51 2022 9 30 06 1148-1161 |
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10.1007/s10953-022-01178-8 doi (DE-627)SPR047847999 (SPR)s10953-022-01178-8-e DE-627 ger DE-627 rakwb eng Ghalandari, Ali verfasserin aut Solvent Effect and Preferential Solvation Analysis of Isophthalic Acid Solubility in Acetone (1) + Water (2) and Acetic Acid (1) + Water (2) Mixtures 2022 Text txt rdacontent Computermedien c rdamedia Online-Ressource cr rdacarrier © The Author(s), under exclusive licence to Springer Science+Business Media, LLC, part of Springer Nature 2022 Abstract Data on solubility of isophthalic acid in acetone (1) + water (2) and acetic acid (1) + water (2) mixtures over the full composition range were used to analyze solvent effect by using linear solvation energy relationships approach considering Kamlet, Abboud, and Taft parameters as solvent descriptors to provide detail information on the solute–solvent and solvent–solvent interactions. Solvent effect analysis revealed which types of interactions were the main essential characteristics of solvent mixtures for solubility variation. Results indicate that cavity term and hydrogen bonding interactions were the main contributors to solvent effect on solubility in aqueous mixtures studied here. The inverse Kirkwood–Buff integral method was used to determine and analyze the possibility of preferential solvation of isophthalic acid by each of solvents in aqueous binary mixtures. The local mole fraction of acetone and acetic acid in solvation shell of isophthalic acid was determined as a function of bulk mole fraction of solvents over the full composition range in binary mixtures. The extent of preferential solvation was discussed by considering the characteristics of isophthalic acid and pure solvents and their possible mutual interactions. In addition, COSMO-RS computation was used for qualitative analysis of intermolecular interactions. Isophthalic acid (dpeaa)DE-He213 Solubility (dpeaa)DE-He213 Solvent effect (dpeaa)DE-He213 Preferential solvation (dpeaa)DE-He213 Local composition (dpeaa)DE-He213 Saadati, Zohreh aut Goodajdar, Bijan Mombeni aut Farajtabar, Ali (orcid)0000-0002-5510-3782 aut Enthalten in Journal of solution chemistry New York, NY [u.a.] : Springer Science + Business Media B.V., 1972 51(2022), 9 vom: 30. Juni, Seite 1148-1161 (DE-627)317881876 (DE-600)2017287-4 1572-8927 nnns volume:51 year:2022 number:9 day:30 month:06 pages:1148-1161 https://dx.doi.org/10.1007/s10953-022-01178-8 lizenzpflichtig Volltext GBV_USEFLAG_A SYSFLAG_A GBV_SPRINGER SSG-OLC-PHA GBV_ILN_11 GBV_ILN_20 GBV_ILN_22 GBV_ILN_23 GBV_ILN_24 GBV_ILN_31 GBV_ILN_32 GBV_ILN_39 GBV_ILN_40 GBV_ILN_60 GBV_ILN_62 GBV_ILN_63 GBV_ILN_69 GBV_ILN_70 GBV_ILN_73 GBV_ILN_74 GBV_ILN_90 GBV_ILN_95 GBV_ILN_100 GBV_ILN_101 GBV_ILN_105 GBV_ILN_110 GBV_ILN_120 GBV_ILN_138 GBV_ILN_150 GBV_ILN_151 GBV_ILN_152 GBV_ILN_161 GBV_ILN_170 GBV_ILN_171 GBV_ILN_187 GBV_ILN_213 GBV_ILN_224 GBV_ILN_230 GBV_ILN_250 GBV_ILN_281 GBV_ILN_285 GBV_ILN_293 GBV_ILN_370 GBV_ILN_602 GBV_ILN_636 GBV_ILN_702 GBV_ILN_2001 GBV_ILN_2003 GBV_ILN_2004 GBV_ILN_2005 GBV_ILN_2006 GBV_ILN_2007 GBV_ILN_2008 GBV_ILN_2009 GBV_ILN_2010 GBV_ILN_2011 GBV_ILN_2014 GBV_ILN_2015 GBV_ILN_2020 GBV_ILN_2021 GBV_ILN_2025 GBV_ILN_2026 GBV_ILN_2027 GBV_ILN_2031 GBV_ILN_2034 GBV_ILN_2037 GBV_ILN_2038 GBV_ILN_2039 GBV_ILN_2044 GBV_ILN_2048 GBV_ILN_2049 GBV_ILN_2050 GBV_ILN_2055 GBV_ILN_2056 GBV_ILN_2057 GBV_ILN_2059 GBV_ILN_2061 GBV_ILN_2064 GBV_ILN_2065 GBV_ILN_2068 GBV_ILN_2088 GBV_ILN_2093 GBV_ILN_2106 GBV_ILN_2107 GBV_ILN_2108 GBV_ILN_2110 GBV_ILN_2111 GBV_ILN_2112 GBV_ILN_2113 GBV_ILN_2118 GBV_ILN_2122 GBV_ILN_2129 GBV_ILN_2143 GBV_ILN_2144 GBV_ILN_2147 GBV_ILN_2148 GBV_ILN_2152 GBV_ILN_2153 GBV_ILN_2188 GBV_ILN_2190 GBV_ILN_2232 GBV_ILN_2336 GBV_ILN_2446 GBV_ILN_2470 GBV_ILN_2472 GBV_ILN_2507 GBV_ILN_2522 GBV_ILN_2548 GBV_ILN_4035 GBV_ILN_4037 GBV_ILN_4046 GBV_ILN_4112 GBV_ILN_4125 GBV_ILN_4126 GBV_ILN_4242 GBV_ILN_4246 GBV_ILN_4249 GBV_ILN_4251 GBV_ILN_4305 GBV_ILN_4306 GBV_ILN_4307 GBV_ILN_4313 GBV_ILN_4322 GBV_ILN_4323 GBV_ILN_4324 GBV_ILN_4325 GBV_ILN_4326 GBV_ILN_4328 GBV_ILN_4333 GBV_ILN_4334 GBV_ILN_4335 GBV_ILN_4336 GBV_ILN_4338 GBV_ILN_4393 GBV_ILN_4700 AR 51 2022 9 30 06 1148-1161 |
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10.1007/s10953-022-01178-8 doi (DE-627)SPR047847999 (SPR)s10953-022-01178-8-e DE-627 ger DE-627 rakwb eng Ghalandari, Ali verfasserin aut Solvent Effect and Preferential Solvation Analysis of Isophthalic Acid Solubility in Acetone (1) + Water (2) and Acetic Acid (1) + Water (2) Mixtures 2022 Text txt rdacontent Computermedien c rdamedia Online-Ressource cr rdacarrier © The Author(s), under exclusive licence to Springer Science+Business Media, LLC, part of Springer Nature 2022 Abstract Data on solubility of isophthalic acid in acetone (1) + water (2) and acetic acid (1) + water (2) mixtures over the full composition range were used to analyze solvent effect by using linear solvation energy relationships approach considering Kamlet, Abboud, and Taft parameters as solvent descriptors to provide detail information on the solute–solvent and solvent–solvent interactions. Solvent effect analysis revealed which types of interactions were the main essential characteristics of solvent mixtures for solubility variation. Results indicate that cavity term and hydrogen bonding interactions were the main contributors to solvent effect on solubility in aqueous mixtures studied here. The inverse Kirkwood–Buff integral method was used to determine and analyze the possibility of preferential solvation of isophthalic acid by each of solvents in aqueous binary mixtures. The local mole fraction of acetone and acetic acid in solvation shell of isophthalic acid was determined as a function of bulk mole fraction of solvents over the full composition range in binary mixtures. The extent of preferential solvation was discussed by considering the characteristics of isophthalic acid and pure solvents and their possible mutual interactions. In addition, COSMO-RS computation was used for qualitative analysis of intermolecular interactions. Isophthalic acid (dpeaa)DE-He213 Solubility (dpeaa)DE-He213 Solvent effect (dpeaa)DE-He213 Preferential solvation (dpeaa)DE-He213 Local composition (dpeaa)DE-He213 Saadati, Zohreh aut Goodajdar, Bijan Mombeni aut Farajtabar, Ali (orcid)0000-0002-5510-3782 aut Enthalten in Journal of solution chemistry New York, NY [u.a.] : Springer Science + Business Media B.V., 1972 51(2022), 9 vom: 30. Juni, Seite 1148-1161 (DE-627)317881876 (DE-600)2017287-4 1572-8927 nnns volume:51 year:2022 number:9 day:30 month:06 pages:1148-1161 https://dx.doi.org/10.1007/s10953-022-01178-8 lizenzpflichtig Volltext GBV_USEFLAG_A SYSFLAG_A GBV_SPRINGER SSG-OLC-PHA GBV_ILN_11 GBV_ILN_20 GBV_ILN_22 GBV_ILN_23 GBV_ILN_24 GBV_ILN_31 GBV_ILN_32 GBV_ILN_39 GBV_ILN_40 GBV_ILN_60 GBV_ILN_62 GBV_ILN_63 GBV_ILN_69 GBV_ILN_70 GBV_ILN_73 GBV_ILN_74 GBV_ILN_90 GBV_ILN_95 GBV_ILN_100 GBV_ILN_101 GBV_ILN_105 GBV_ILN_110 GBV_ILN_120 GBV_ILN_138 GBV_ILN_150 GBV_ILN_151 GBV_ILN_152 GBV_ILN_161 GBV_ILN_170 GBV_ILN_171 GBV_ILN_187 GBV_ILN_213 GBV_ILN_224 GBV_ILN_230 GBV_ILN_250 GBV_ILN_281 GBV_ILN_285 GBV_ILN_293 GBV_ILN_370 GBV_ILN_602 GBV_ILN_636 GBV_ILN_702 GBV_ILN_2001 GBV_ILN_2003 GBV_ILN_2004 GBV_ILN_2005 GBV_ILN_2006 GBV_ILN_2007 GBV_ILN_2008 GBV_ILN_2009 GBV_ILN_2010 GBV_ILN_2011 GBV_ILN_2014 GBV_ILN_2015 GBV_ILN_2020 GBV_ILN_2021 GBV_ILN_2025 GBV_ILN_2026 GBV_ILN_2027 GBV_ILN_2031 GBV_ILN_2034 GBV_ILN_2037 GBV_ILN_2038 GBV_ILN_2039 GBV_ILN_2044 GBV_ILN_2048 GBV_ILN_2049 GBV_ILN_2050 GBV_ILN_2055 GBV_ILN_2056 GBV_ILN_2057 GBV_ILN_2059 GBV_ILN_2061 GBV_ILN_2064 GBV_ILN_2065 GBV_ILN_2068 GBV_ILN_2088 GBV_ILN_2093 GBV_ILN_2106 GBV_ILN_2107 GBV_ILN_2108 GBV_ILN_2110 GBV_ILN_2111 GBV_ILN_2112 GBV_ILN_2113 GBV_ILN_2118 GBV_ILN_2122 GBV_ILN_2129 GBV_ILN_2143 GBV_ILN_2144 GBV_ILN_2147 GBV_ILN_2148 GBV_ILN_2152 GBV_ILN_2153 GBV_ILN_2188 GBV_ILN_2190 GBV_ILN_2232 GBV_ILN_2336 GBV_ILN_2446 GBV_ILN_2470 GBV_ILN_2472 GBV_ILN_2507 GBV_ILN_2522 GBV_ILN_2548 GBV_ILN_4035 GBV_ILN_4037 GBV_ILN_4046 GBV_ILN_4112 GBV_ILN_4125 GBV_ILN_4126 GBV_ILN_4242 GBV_ILN_4246 GBV_ILN_4249 GBV_ILN_4251 GBV_ILN_4305 GBV_ILN_4306 GBV_ILN_4307 GBV_ILN_4313 GBV_ILN_4322 GBV_ILN_4323 GBV_ILN_4324 GBV_ILN_4325 GBV_ILN_4326 GBV_ILN_4328 GBV_ILN_4333 GBV_ILN_4334 GBV_ILN_4335 GBV_ILN_4336 GBV_ILN_4338 GBV_ILN_4393 GBV_ILN_4700 AR 51 2022 9 30 06 1148-1161 |
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Ghalandari, Ali misc Isophthalic acid misc Solubility misc Solvent effect misc Preferential solvation misc Local composition Solvent Effect and Preferential Solvation Analysis of Isophthalic Acid Solubility in Acetone (1) + Water (2) and Acetic Acid (1) + Water (2) Mixtures |
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Solvent Effect and Preferential Solvation Analysis of Isophthalic Acid Solubility in Acetone (1) + Water (2) and Acetic Acid (1) + Water (2) Mixtures Isophthalic acid (dpeaa)DE-He213 Solubility (dpeaa)DE-He213 Solvent effect (dpeaa)DE-He213 Preferential solvation (dpeaa)DE-He213 Local composition (dpeaa)DE-He213 |
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Solvent Effect and Preferential Solvation Analysis of Isophthalic Acid Solubility in Acetone (1) + Water (2) and Acetic Acid (1) + Water (2) Mixtures |
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Solvent Effect and Preferential Solvation Analysis of Isophthalic Acid Solubility in Acetone (1) + Water (2) and Acetic Acid (1) + Water (2) Mixtures |
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solvent effect and preferential solvation analysis of isophthalic acid solubility in acetone (1) + water (2) and acetic acid (1) + water (2) mixtures |
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Solvent Effect and Preferential Solvation Analysis of Isophthalic Acid Solubility in Acetone (1) + Water (2) and Acetic Acid (1) + Water (2) Mixtures |
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Abstract Data on solubility of isophthalic acid in acetone (1) + water (2) and acetic acid (1) + water (2) mixtures over the full composition range were used to analyze solvent effect by using linear solvation energy relationships approach considering Kamlet, Abboud, and Taft parameters as solvent descriptors to provide detail information on the solute–solvent and solvent–solvent interactions. Solvent effect analysis revealed which types of interactions were the main essential characteristics of solvent mixtures for solubility variation. Results indicate that cavity term and hydrogen bonding interactions were the main contributors to solvent effect on solubility in aqueous mixtures studied here. The inverse Kirkwood–Buff integral method was used to determine and analyze the possibility of preferential solvation of isophthalic acid by each of solvents in aqueous binary mixtures. The local mole fraction of acetone and acetic acid in solvation shell of isophthalic acid was determined as a function of bulk mole fraction of solvents over the full composition range in binary mixtures. The extent of preferential solvation was discussed by considering the characteristics of isophthalic acid and pure solvents and their possible mutual interactions. In addition, COSMO-RS computation was used for qualitative analysis of intermolecular interactions. © The Author(s), under exclusive licence to Springer Science+Business Media, LLC, part of Springer Nature 2022 |
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Abstract Data on solubility of isophthalic acid in acetone (1) + water (2) and acetic acid (1) + water (2) mixtures over the full composition range were used to analyze solvent effect by using linear solvation energy relationships approach considering Kamlet, Abboud, and Taft parameters as solvent descriptors to provide detail information on the solute–solvent and solvent–solvent interactions. Solvent effect analysis revealed which types of interactions were the main essential characteristics of solvent mixtures for solubility variation. Results indicate that cavity term and hydrogen bonding interactions were the main contributors to solvent effect on solubility in aqueous mixtures studied here. The inverse Kirkwood–Buff integral method was used to determine and analyze the possibility of preferential solvation of isophthalic acid by each of solvents in aqueous binary mixtures. The local mole fraction of acetone and acetic acid in solvation shell of isophthalic acid was determined as a function of bulk mole fraction of solvents over the full composition range in binary mixtures. The extent of preferential solvation was discussed by considering the characteristics of isophthalic acid and pure solvents and their possible mutual interactions. In addition, COSMO-RS computation was used for qualitative analysis of intermolecular interactions. © The Author(s), under exclusive licence to Springer Science+Business Media, LLC, part of Springer Nature 2022 |
| abstract_unstemmed |
Abstract Data on solubility of isophthalic acid in acetone (1) + water (2) and acetic acid (1) + water (2) mixtures over the full composition range were used to analyze solvent effect by using linear solvation energy relationships approach considering Kamlet, Abboud, and Taft parameters as solvent descriptors to provide detail information on the solute–solvent and solvent–solvent interactions. Solvent effect analysis revealed which types of interactions were the main essential characteristics of solvent mixtures for solubility variation. Results indicate that cavity term and hydrogen bonding interactions were the main contributors to solvent effect on solubility in aqueous mixtures studied here. The inverse Kirkwood–Buff integral method was used to determine and analyze the possibility of preferential solvation of isophthalic acid by each of solvents in aqueous binary mixtures. The local mole fraction of acetone and acetic acid in solvation shell of isophthalic acid was determined as a function of bulk mole fraction of solvents over the full composition range in binary mixtures. The extent of preferential solvation was discussed by considering the characteristics of isophthalic acid and pure solvents and their possible mutual interactions. In addition, COSMO-RS computation was used for qualitative analysis of intermolecular interactions. © The Author(s), under exclusive licence to Springer Science+Business Media, LLC, part of Springer Nature 2022 |
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Solvent Effect and Preferential Solvation Analysis of Isophthalic Acid Solubility in Acetone (1) + Water (2) and Acetic Acid (1) + Water (2) Mixtures |
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https://dx.doi.org/10.1007/s10953-022-01178-8 |
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Saadati, Zohreh Goodajdar, Bijan Mombeni Farajtabar, Ali |
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| score |
7.4008837 |