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Articles

Ion-specific equation coefficient version of the Abraham model for ionic liquid solvents: determination of coefficients for tributylethylphosphonium, 1-butyl-1-methylmorpholinium, 1-allyl-3-methylimidazolium and octyltriethylammonium cations

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Pages 358-385 | Received 30 Jun 2016, Accepted 25 Jul 2016, Published online: 08 Aug 2016

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Nikita Shanmugam, Amy Zhou, Catherine Webber, Emily Yao & William E. Acree. (2024) Abraham solvation parameter model: determination of experiment-based solute descriptor values for 3,5-dimethoxybenzoic acid based on measured solubility data. Physics and Chemistry of Liquids 62:2, pages 89-100.
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Trisha Kandi, Ramya Motati, Saikiran Motati, Nikita Shanmugam, Amy Zhou, Emily Yao, Catherine Webber & William E. Acree$suffix/text()$suffix/text(). (2023) Updated Abraham model correlations for describing solute transfer into both 2-Pentanol and 3-Methyl-1-butanol based on much larger data sets. Physics and Chemistry of Liquids 61:6, pages 405-420.
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Darla Benavides, Laine Longacre, Advika Varadharajan & William E. Acree. (2023) Calculation of Abraham model solute descriptors for 2-naphthoxyacetic acid. Physics and Chemistry of Liquids 61:4, pages 264-274.
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Alyssa Daniel, Kelly Kim, Neel Shanmugam, Sneha Sinha, Advika Varadharajan & William E. Acree. (2022) Abraham model correlations for solute transfer into cyclopentanone. Physics and Chemistry of Liquids 60:6, pages 964-976.
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Katherine Smart, Erin Connolly, Libby Ocon, Teresa Golden, William E. Acree & Michael H. Abraham. (2022) Abraham model correlations for describing the partition of organic compounds from water into the methyl ethyl ketone extraction solvent. Physics and Chemistry of Liquids 60:1, pages 47-58.
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Michael H Abraham & William E. Acree. (2021) Descriptors for fluorotelomere alcohols. Calculation of physicochemical properties. Physics and Chemistry of Liquids 59:6, pages 932-937.
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Shrika Eddula, Angelina Xu, Carina Jiang, Jennifer Huang, Priya Tirumala, Grace Liu, William E. Acree & Michael H. Abraham. (2021) Abraham solvation parameter model: updated correlations for describing solute partitioning into plant cuticles from water and from air. Physics and Chemistry of Liquids 59:5, pages 716-732.
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Brittani Churchill, Theresa Casillas, William E. Acree$suffix/text()$suffix/text() & Michael H. Abraham. (2021) Abraham solvation parameter model: calculation of ion-specific equation coefficients for the N-Ethyl-N-methylmorpholinium and N-Octyl-N-methylmorpholinium cations. Physics and Chemistry of Liquids 59:4, pages 575-584.
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Sara Strickland, Libby Ocon, Alex Zhang, Shang Wang, Shrika Eddula, Grace Liu, Priya Tirumala, Jennifer Huang, Jingyi Dai, Carina Jiang, William E. Acree & Michael H. Abraham. (2021) Abraham model correlations for describing dissolution of organic solutes and inorganic gases in dimethyl carbonate. Physics and Chemistry of Liquids 59:2, pages 181-195.
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Jonathan Z. Lu, William E. Acree$suffix/text()$suffix/text() & Michael H. Abraham. (2020) Abraham model correlations for enthalpies of solvation of organic solutes dissolved in N,N-Dimethylacetamide, 2-butanone and tetrahydrofuran (UPDATED) at 298.15 K. Physics and Chemistry of Liquids 58:5, pages 675-692.
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Ellen Qian, Avi Gupta, Reese Neal, Grace Lee, Melanie Che, Lainey Wang, David Yue, Rachel Fischer, Megan Jodray, Erin Connolly, Shang Wang, Kelly Liu, Alex Zhang, Jingyi Dai, Siqi Zhu, William E. Acree$suffix/text()$suffix/text() & Michael H. Abraham. (2020) Development of Abraham model correlations for describing solute transfer into 2-methyl-1-butanol from both water and the gas phase from experimental solubility data of crystalline organic compounds. Physics and Chemistry of Liquids 58:5, pages 623-635.
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Jonathan Z. Lu, William E. Acree$suffix/text()$suffix/text() & Michael H. Abraham. (2020) Abraham model correlations for enthalpies of solvation of organic solutes dissolved in methyl acetate and octane. Physics and Chemistry of Liquids 58:1, pages 18-30.
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David Yue, William E. Acree$suffix/text()$suffix/text() & Michael H. Abraham. (2019) Development of Abraham model IL-specific correlations for N-triethyl(octyl)ammonium bis(fluorosulfonyl)imide and 1-butyl-3-methylpyrrolidinium bis(fluorosulfonyl)imide. Physics and Chemistry of Liquids 57:6, pages 733-745.
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Grace Lee, Melanie Che, Ellen Qian, Lainey Wang, Avi Gupta, Reese Neal, David Yue, Samantha Downs, Tiffany Mayes, Olivia Rose, William E. Acree$suffix/text()$suffix/text() & Michael H. Abraham. (2019) Determination of Abraham model solute descriptors for o-acetoacetanisidide based on experimental solubility data in organic mono-solvents. Physics and Chemistry of Liquids 57:4, pages 528-535.
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Erin Hart, Grace Lee, Ellen Qian, Megan Jodray, Maribel Barrera, Rachel Fischer, Melanie Che, Yuqing Liu, Olivia Zha, Delani Woods, William E. Acree$suffix/text()$suffix/text() & Michael H. Abraham. (2019) Determination of Abraham model solute descriptors for 4-tert-butylbenzoic acid from experimental solubility data in organic mono-solvents. Physics and Chemistry of Liquids 57:4, pages 445-452.
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Xin Tong, Delani Woods, William E. Acree & Michael H Abraham. (2018) Updated Abraham model correlations for correlating solute transfer into dry butanone and dry cyclohexanone solvents. Physics and Chemistry of Liquids 56:5, pages 571-583.
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Erin Hart, Alex Klein, Olivia Zha, Anisha Wadawadigi, Ellen Qian, Sarah Dunn, Janna Herron, Ketsia Kankolongo, Shy’an Ryan, William E. Acree$suffix/text()$suffix/text() & Michael H. Abraham. (2018) Determination of Abraham model solute descriptors for monomeric 3,4,5-trimethoxybenzoic acid from experimental solubility data in organic solvents measured at 298.2 K. Physics and Chemistry of Liquids 56:3, pages 381-390.
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Erin Hart, Ashley M. Ramirez, Sarah Cheeran, Maribel Barrera, Melissa Y. Horton, Anisha Wadawadigi, William E. Acree$suffix/text()$suffix/text() & Michael H. Abraham. (2017) Determination of Abraham model solute descriptors for 2-methyl-3-nitrobenzoic acid from measured solubility data in alcohol, alkyl ether, alkyl acetate and 2-alkoxyalcohol mono-solvents. Physics and Chemistry of Liquids 55:6, pages 796-804.
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William E. Acree$suffix/text()$suffix/text(), Kaci R. Bowen, Melissa Y. Horton & Michael H. Abraham. (2017) Computation of Abraham model solute descriptors for 3-methyl-4-nitrobenzoic acid from measured solubility data. Physics and Chemistry of Liquids 55:4, pages 482-491.
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Articles from other publishers (21)

Zuo-yuan Zhang, Xiaohui Wang, Qiaole He & Zhaoxi Sun. (2023) Chemical accuracy prediction of molecular solvation and partition in ionic liquids with educated estimators. Journal of Molecular Liquids 391, pages 123202.
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Saikiran Motati, Ramya Motati, Trisha Kandi & William E. AcreeJr.Jr.. (2023) Abraham Model Descriptors for Vitamin K4: Prediction of Solution, Biological and Thermodynamic Properties. Liquids 3:4, pages 402-413.
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William E. AcreeJr.Jr. & Andrew S. I. D. Lang. (2023) Reichardt’s Dye-Based Solvent Polarity and Abraham Solvent Parameters: Examining Correlations and Predictive Modeling. Liquids 3:3, pages 303-313.
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Emily Yao, Amy Zhou, Shuhan Wu, Nikita Shanmugam, Advika Varadharajan, Sneha Sinha, Emily Wu & William E. AcreeJr.Jr.. (2023) Determination of Abraham Model Solute Descriptors for N-Hydroxyphthalimide: An Organic Compound Having a N-Hydroxy (N–OH) Functional Group. Journal of Solution Chemistry 52:8, pages 895-909.
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Jia‐Xi Chang, Jian‐Wei Zou, Chao‐Yuan Lou, Jia‐Xin Ye, Rui Feng, Zi‐Yuan Li & Gui‐Xiang Hu. (2023) Gas‐to‐ionic liquid partition: QSPR modeling and mechanistic interpretation. Molecular Informatics 42:6.
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Amy Zhou, Laine Longacre, Ramya Motati & William E. AcreeJr.Jr.. (2023) Abraham Solvation Parameter Model: Revised Predictive Expressions for Solute Transfer into Polydimethylsiloxane Based on Much Larger and Chemically Diverse Datasets. Compounds 3:1, pages 205-223.
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Timur I. Magsumov, Igor A. Sedov & William E. AcreeJr.Jr.. (2021) Development of Predictive Expressions for Infinite Dilution Activity Coefficients, Molar Solubilities and Partition Coefficients for Solutes Dissolved in 2-Pyrrolidone Based on the Abraham Solvation Parameter Model. Journal of Solution Chemistry 51:9, pages 975-991.
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Xiangli Liu, William E. AcreeJr.Jr. & Michael H. Abraham. (2022) Descriptors for some compounds with pharmacological activity; calculation of properties. International Journal of Pharmaceutics 617, pages 121597.
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Michael H. Abraham & Ricardo Sánchez-Moreno. (2021) Determination of Water–Solvent Partition Coefficients for Fluorescein: Evaluation of Descriptors for the Lactone Form and Prediction of Properties. Journal of Solution Chemistry 50:7, pages 1027-1035.
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Xiangli Liu, Michael H. Abraham & William E. AcreeJrJr. (2021) Descriptors for vitamin K3 (menadione); calculation of biological and physicochemical properties. Journal of Molecular Liquids 330, pages 115707.
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Colin F. Poole & Sanka N. Atapattu. (2021) Determination of physicochemical properties of ionic liquids by gas chromatography. Journal of Chromatography A 1644, pages 461964.
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Fabrice Mutelet, Gary A. Baker, Hua Zhao, Brittani Churchill & William E. AcreeJr.Jr.. (2020) Development of Abraham model correlations for short-chain glycol-grafted imidazolium and pyridinium ionic liquids from inverse gas-chromatographic measurements. Journal of Molecular Liquids 317, pages 113983.
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Igor A. Sedov, Timur M. Salikov, Ellen Qian, Anisha Wadawadigi, Olivia Zha, William E. AcreeJrJr & Michael H. Abraham. (2019) Abraham model correlations for solute transfer into 2-methyl-2-butanol based on measured activity coefficient and solubility data at 298.15 K. Journal of Molecular Liquids 293, pages 111454.
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Igor A. Sedov, Timur M. Salikov, Anisha Wadawadigi, Olivia Zha, Ellen Qian, William E. AcreeJr.Jr. & Michael H. Abraham. (2018) Abraham model correlations for describing the thermodynamic properties of solute transfer into pentyl acetate based on headspace chromatographic and solubility measurements. The Journal of Chemical Thermodynamics 124, pages 133-140.
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Seyyedeh Narjes Mirheydari, Jafar Soleymani, Vahid Jouyban-Gharamaleki, Mohammad Barzegar-Jalali, Abolghasem Jouyban & Hemayat Shekaari. (2018) Viscosity prediction of ionic liquid + molecular solvent mixtures at various temperatures. Journal of Molecular Liquids 263, pages 228-236.
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Michael H. Abraham & William E. AcreeJr.Jr.. (2018) Descriptors for the α,ω-dicarboxylic acids from oxalic acid to sebacic acid. Fluid Phase Equilibria 467, pages 17-24.
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Michael H. Abraham & William E. AcreeJr.Jr.. (2018) Descriptors for Cyclooctasulfur: Estimation of Water–Solvent Partition Coefficients, Solubilities in Solvents, and Physicochemical Properties. ACS Omega 3:5, pages 5516-5521.
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Igor A. Sedov, Timur I. Magsumov, Erin Hart, Ashley M. Ramirez, Sarah Cheeran, Maribel Barrera, Melissa Y. Horton, Anisha Wadawadigi, Olivia Zha, Xin Y. Tong, William E. AcreeJr.Jr. & Michael H. Abraham. (2017) Abraham Model Correlations for Triethylene Glycol Solvent Derived from Infinite Dilution Activity Coefficient, Partition Coefficient and Solubility Data Measured at 298.15 K. Journal of Solution Chemistry 46:12, pages 2249-2267.
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Michael H. Abraham & William E. AcreeJr.Jr.. (2017) Descriptors for Pentane-2,4-dione and Its Derivatives. Journal of Solution Chemistry 46:8, pages 1625-1638.
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Michael H. Abraham & William E. AcreeJrJr. (2017) Gas-solvent and water-solvent partition of trans -stilbene at 298 K. Journal of Molecular Liquids 238, pages 58-61.
Crossref
William E. AcreeJr.Jr., Maribel Barrera & Michael H. Abraham. (2016) Comment on “Measurement and Correlation of the Solubility of p -Coumaric Acid in Nine Pure and Water + Ethanol Mixed Solvents at Temperatures from 293.15 to 333.15 K” . Journal of Chemical & Engineering Data 62:1, pages 578-583.
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