Works by Acree, William E.

Results: 253

Experiment-based Abraham model solute descriptors for 2‑[4-(dibutylamino)-2-hydroxybenzoyl]benzoic acid.

Published in:

Physics & Chemistry of Liquids, 2025, v. 63, n. 3, p. 449, doi. 10.1080/00319104.2024.2429063

By:

Chen, Audrey;
Chen, Jocelyn;
Kowtha, Sri;
Bhupathi Raju, Nitya;
Acree, William E.

Publication type:

Article

Development of Abraham model correlations for predicting the solubility of crystalline organic compounds and inorganic gases in ethyl formate.

Published in:

Physics & Chemistry of Liquids, 2025, v. 63, n. 3, p. 380, doi. 10.1080/00319104.2024.2412037

By:

Wilson, Chelsi;
Kabin, Allison;
Prewitt, Carrie;
Acree, William E.

Publication type:

Article

Descriptors for High‐Energy Nitro Compounds; Estimation of Thermodynamic, Physicochemical and Environmental Properties.

Published in:

Propellants, Explosives, Pyrotechnics, 2021, v. 46, n. 2, p. 267, doi. 10.1002/prep.202000117

By:

Abraham, Michael H.;
Acree, William E.;
Liu, Xiangli

Publication type:

Article

Effect of Intramolecular Hydrogen Bond Formation on the Abraham Model Solute Descriptors for Oxybenzone.

Published in:

Liquids (2673-8015), 2024, v. 4, n. 3, p. 647, doi. 10.3390/liquids4030036

By:

Chen, Jocelyn;
Chen, Audrey;
Yang, Yixuan;
Acree, William E.

Publication type:

Article

Abraham General Solvation Parameter Model: Predictive Expressions for Solute Transfer into Isobutyl Acetate.

Published in:

Liquids (2673-8015), 2024, v. 4, n. 3, p. 470, doi. 10.3390/liquids4030026

By:

Motati, Ramya;
Kandi, Trisha;
Francis, Jilawan;
Chen, Jocelyn;
Yao, Emily;
Motati, Saikiran;
Chen, Audrey;
Kumarandurai, Dhishithaa;
Shanmugam, Nikita;
Acree Jr., William E.

Publication type:

Article

Calculation of the Three Partition Coefficients logP ow , logK oa and logK aw of Organic Molecules at Standard Conditions at Once by Means of a Generally Applicable Group-Additivity Method.

Published in:

Liquids (2673-8015), 2024, v. 4, n. 1, p. 231, doi. 10.3390/liquids4010011

By:

Naef, Rudolf;
Acree Jr., William E.

Publication type:

Article

Revisiting the Total Hildebrand and Partial Hansen Solubility Parameters of Analgesic Drug Meloxicam.

Published in:

Liquids (2673-8015), 2023, v. 3, n. 4, p. 469, doi. 10.3390/liquids3040030

By:

Tinjacá, Darío A.;
Martinez, Fleming;
Peña, María Angeles;
Jouyban, Abolghasem;
Acree Jr., William E.

Publication type:

Article

Abraham Model Descriptors for Vitamin K4: Prediction of Solution, Biological and Thermodynamic Properties.

Published in:

Liquids (2673-8015), 2023, v. 3, n. 4, p. 402, doi. 10.3390/liquids3040025

By:

Motati, Saikiran;
Motati, Ramya;
Kandi, Trisha;
Acree Jr., William E.

Publication type:

Article

Reichardt's Dye-Based Solvent Polarity and Abraham Solvent Parameters: Examining Correlations and Predictive Modeling.

Published in:

Liquids (2673-8015), 2023, v. 3, n. 3, p. 303, doi. 10.3390/liquids3030020

By:

Acree Jr., William E.;
Lang, Andrew S. I. D.

Publication type:

Article

Determination of Abraham Model Solute Descriptors for 62 Additional C 10 through C 13 Methyl- and Ethyl-Branched Alkanes.

Published in:

Liquids (2673-8015), 2023, v. 3, n. 1, p. 118, doi. 10.3390/liquids3010010

By:

Motati, Ramya;
Acree Jr., William E.

Publication type:

Article

Correlation of Surface Tension of Mono-Solvents at Various Temperatures.

Published in:

Liquids (2673-8015), 2022, v. 2, n. 4, p. 378, doi. 10.3390/liquids2040021

By:

Kabudi, Navid;
Shayanfar, Ali;
Acree Jr., William E.;
Jouyban, Abolghasem

Publication type:

Article

Revision and Extension of a Generally Applicable Group Additivity Method for the Calculation of the Refractivity and Polarizability of Organic Molecules at 298.15 K.

Published in:

Liquids (2673-8015), 2022, v. 2, n. 4, p. 327, doi. 10.3390/liquids2040020

By:

Naef, Rudolf;
Acree Jr., William E.

Publication type:

Article

Estimating Equivalent Alkane Carbon Number Using Abraham Solute Parameters.

Published in:

Liquids (2673-8015), 2022, v. 2, n. 4, p. 318, doi. 10.3390/liquids2040019

By:

Acree Jr., William E.;
Chong, Wei-Khiong;
Lang, Andrew S.I.D.;
Mozafari, Hamed

Publication type:

Article

Development of Abraham Model Correlations for Solute Transfer into the tert -Butyl Acetate Mono-Solvent and Updated Equations for Both Ethyl Acetate and Butyl Acetate.

Published in:

Liquids (2673-8015), 2022, v. 2, n. 4, p. 258, doi. 10.3390/liquids2040016

By:

Longacre, Laine;
Wu, Emily;
Yang, Chelsea;
Zhang, Miles;
Sinha, Sneha;
Varadharajan, Advika;
Acree Jr., William E.

Publication type:

Article

Abraham Solvation Parameter Model: Calculation of L Solute Descriptors for Large C 11 to C 42 Methylated Alkanes from Measured Gas–Liquid Chromatographic Retention Data.

Published in:

Liquids (2673-8015), 2022, v. 2, n. 3, p. 85, doi. 10.3390/liquids2030007

By:

Wu, Emily;
Sinha, Sneha;
Yang, Chelsea;
Zhang, Miles;
Acree Jr., William E.

Publication type:

Article

Increasing the Equilibrium Solubility of Meloxicam in Aqueous Media by Using Dimethyl Sulfoxide as a Cosolvent: Correlation, Dissolution Thermodynamics and Preferential Solvation.

Published in:

Liquids (2673-8015), 2022, v. 2, n. 3, p. 161, doi. 10.3390/liquids2030011

By:

Tinjacá, Darío A.;
Martínez, Fleming;
Almanza, Ovidio A.;
Peña, M. Ángeles;
Jouyban, Abolghasem;
Acree Jr., William E.

Publication type:

Article

Abraham Solvation Parameter Model: Examination of Possible Intramolecular Hydrogen-Bonding Using Calculated Solute Descriptors.

Published in:

Liquids (2673-8015), 2022, v. 2, n. 3, p. 131, doi. 10.3390/liquids2030009

By:

Sinha, Sneha;
Yang, Chelsea;
Wu, Emily;
Acree Jr., William E.

Publication type:

Article

The prediction of blood-tissue partitions, water-skin partitions and skin permeation for agrochemicals.

Published in:

Pest Management Science, 2014, v. 70, n. 7, p. 1130, doi. 10.1002/ps.3658

By:

Abraham, Michael H;
Gola, Joelle MR;
Ibrahim, Adam;
Acree, William E;
Liu, Xiangli

Publication type:

Article

Thermodynamics of Mobile Order Theory. Part 3. Comparison of Experimental and Predicted Solubilities for Fluoranthene and Pyrene.

Published in:

Polycyclic Aromatic Compounds, 1999, v. 13, n. 3, p. 205, doi. 10.1080/10406639908020564

By:

Roy, Lindsay E.;
HernÁandez, Carmen E.;
Acree, William E.

Publication type:

Article

Solubility of Anthracene in Organic Nonelectrolyte Solvents. Comparison of Observed Versus Predicted Values Based Upon Mobile Order Theory.

Published in:

Polycyclic Aromatic Compounds, 1999, v. 13, n. 1, p. 105, doi. 10.1080/10406639908020546

By:

Roy, Lindsay E.;
HernÁndez, Carmen E.;
Acree, William E.

Publication type:

Article

Classification of Select Aceanthrylenes, Acephenanthrylenes and Dicyclopentapyrenes as Alternant versus Nonalternant Polycyclic Aromatic Hydrocarbons on the Basis of Their Fluorescence Quenching Behavior in the Presence of Nitromethane and Cetylpyridinium Cation Selective Quenching Agents

Published in:

Polycyclic Aromatic Compounds, 1999, v. 13, n. 1, p. 79, doi. 10.1080/10406639908020544

By:

Pandey, Siddharth;
Acree, William E.;
Scott, Lawrence T.;
Necula, Atena;
Fetzer, John C.;
Mulder, Patrick P. J.;
Lugtenburg, Johan;
Cornelisse, Jan

Publication type:

Article

Spectrofluorometric Analysis of Aromatic Compounds: Review of Applicability of Nitromethane as a Selective Fluorescence Quenching Agent for Identification of Alternant vs. Nonalternant Polycyclic Aromatic Hydrocarbons.

Published in:

Polycyclic Aromatic Compounds, 1997, v. 12, n. 2, p. 71, doi. 10.1080/10406639708233830

By:

Acree, William E.;
Pandey, Siddharth;
Tucker, Sheryl A.;
Fetzer, John C.

Publication type:

Article

Spectroscopic Properties of Polycyclic Aromatic Compounds. Part 5. The Nitromethane Selective Quenching Rule Revisited in Aqueous Micellar Solvent Media.

Published in:

Polycyclic Aromatic Compounds, 1997, v. 12, n. 1, p. 1, doi. 10.1080/10406639708233824

By:

Pandey, Siddharth;
Powell, Joyce R.;
Acree, William E.;
Cho, Bongsup P.;
Kum, Jennifer;
Yang, Chengxi;
Harvey, Ronald G.

Publication type:

Article

Solubility of Crystalline Nonelectrolyte Solutes in Organic Solvents: Mathematical Correlation of 3-Chlorobenzoic Acid Solubilities with the Abraham Solvation Parameter Model.

Published in:

South African Journal of Chemistry, 2005, v. 58, p. 25

By:

Hoover, Kaci R.;
Pop, Krisztina;
Acree Jr., William E.;
Abraham, Michael H.

Publication type:

Article

Drug Solubility Correlation Using the Jouyban–Acree Model: Effects of Concentration Units and Error Criteria.

Published in:

Molecules, 2022, v. 27, n. 6, p. 1998, doi. 10.3390/molecules27061998

By:

Rahimpour, Elaheh;
Alvani-Alamdari, Sima;
Acree Jr., William E.;
Jouyban, Abolghasem

Publication type:

Article

Revision and Extension of a Generally Applicable Group-Additivity Method for the Calculation of the Standard Heat of Combustion and Formation of Organic Molecules.

Published in:

Molecules, 2021, v. 26, n. 20, p. 6101, doi. 10.3390/molecules26206101

By:

Naef, Rudolf;
Acree Jr., William E.

Publication type:

Article

Calculation of the Vapour Pressure of Organic Molecules by Means of a Group-Additivity Method and Their Resultant Gibbs Free Energy and Entropy of Vaporization at 298.15 K.

Published in:

Molecules, 2021, v. 26, n. 4, p. 1045, doi. 10.3390/molecules26041045

By:

Naef, Rudolf;
Acree Jr., William E.;
Belpassi, Leonardo

Publication type:

Article

Solubility Determination of c-Met Inhibitor in Solvent Mixtures and Mathematical Modeling to Develop Nanosuspension Formulation.

Published in:

Molecules, 2021, v. 26, n. 2, p. 390, doi. 10.3390/molecules26020390

By:

Ravi, Maharjan;
Julu, Tripathi;
Kim, Nam Ah;
Park, Kyeung Eui;
Jeong, Seong Hoon;
Acree Jr., William E.

Publication type:

Article

The Equilibria in Lipid–Lipoic Acid Systems: Monolayers, Microelectrophoretic and Interfacial Tension Studies.

Published in:

Molecules, 2020, v. 25, n. 16, p. 3678, doi. 10.3390/molecules25163678

By:

Laszuk, Paulina;
Urbaniak, Wiesław;
Petelska, Aneta D.;
Acree, William E.;
Müller, Erich A.

Publication type:

Article

Solubility Data of the Bioactive Compound Piperine in (Transcutol + Water) Mixtures: Computational Modeling, Hansen Solubility Parameters and Mixing Thermodynamic Parameters.

Published in:

Molecules, 2020, v. 25, n. 12, p. 2743, doi. 10.3390/molecules25122743

By:

Shakeel, Faiyaz;
Haq, Nazrul;
Alshehri, Sultan;
Acree, William E.

Publication type:

Article

Calculation of the Surface Tension of Ordinary Organic and Ionic Liquids by Means of a Generally Applicable Computer Algorithm Based on the Group-Additivity Method.

Published in:

Molecules, 2018, v. 23, n. 5, p. 1224, doi. 10.3390/molecules23051224

By:

Naef, Rudolf;
Acree, William E.

Publication type:

Article

Application of a General Computer Algorithm Based on the Group-Additivity Method for the Calculation of Two Molecular Descriptors at Both Ends of Dilution: Liquid Viscosity and Activity Coefficient in Water at Infinite Dilution.

Published in:

Molecules, 2018, v. 23, n. 1, p. 5, doi. 10.3390/molecules23010005

By:

Naef, Rudolf;
Acree, William E.

Publication type:

Article

Calculation of Five Thermodynamic Molecular Descriptors by Means of a General Computer Algorithm Based on the Group-Additivity Method: Standard Enthalpies of Vaporization, Sublimation and Solvation, and Entropy of Fusion of Ordinary Organic Molecules and Total Phase-Change Entropy of Liquid Crystals

Published in:

Molecules, 2017, v. 22, n. 7, p. 1059, doi. 10.3390/molecules22071059

By:

Naef, Rudolf;
Acree Jr., William E.

Publication type:

Article

Prediction of Bovine Serum Albumin-Water Partition Coefficients of a Wide Variety of Neutral Organic Compounds by Means of Support Vector Machine.

Published in:

Molecular Informatics, 2012, v. 31, n. 11/12, p. 867, doi. 10.1002/minf.201200091

By:

Golmohammadi, Hassan;
Dashtbozorgi, Zahra;
Acree, William E.

Publication type:

Article

A Novel QSPR Model for Prediction of Gas to Dimethyl Sulfoxide Solvation Enthalpy of Organic Compounds Based on Support Vector Machine.

Published in:

Molecular Informatics, 2012, v. 31, n. 5, p. 385, doi. 10.1002/minf.201200007

By:

Golmohammadi, Hassan;
Dashtbozorgi, Zahra;
Acree, William E.

Publication type:

Article

Comments Concerning “Equilibrium Phase Diagram of the Ternary 2-Nitrobenzoic Acid + 3-Nitrobenzoic Acid + Acetone System at 283.15 and 313.15 K”.

Published in:

Journal of Phase Equilibria & Diffusion, 2009, v. 30, n. 4, p. 306, doi. 10.1007/s11669-009-9532-z

By:

Acree Jr., William E.

Publication type:

Article

Descriptors for the Prediction of Partition Coefficients of 8-Hydroxyquinoline and its Derivatives.

Published in:

Separation Science & Technology, 2014, v. 49, n. 14, p. 2135, doi. 10.1080/01496395.2014.928768

By:

Abraham, Michael H.;
Acree, William E.

Publication type:

Article

Descriptors for the Prediction of Partition Coefficients and Solubilities of Organophosphorus Compounds.

Published in:

Separation Science & Technology, 2013, v. 48, n. 6, p. 884, doi. 10.1080/01496395.2012.721043

By:

Abraham, Michael H.;
Acree, William E.

Publication type:

Article

Smart systems for determination of drug's solubility.

Published in:

Drug Development & Industrial Pharmacy, 2019, v. 45, n. 2, p. 177, doi. 10.1080/03639045.2018.1529786

By:

Jouyban-Gharamaleki, Vahid;
Jouyban, Abolghasem;
Acree, William E.;
Rahimpour, Elaheh

Publication type:

Article

Comments on "Estimation of the solubility with cosolvent composition by combinated of the Williams–Amidon model with quasi virial coefficient".

Published in:

Asia-Pacific Journal of Chemical Engineering, 2020, v. 15, n. 1, p. N.PAG, doi. 10.1002/apj.2387

By:

Acree, William E.

Publication type:

Article

Using water-solvent systems to estimate in vivo blood-tissue partition coefficients.

Published in:

Chemistry Central Journal, 2015, p. 1, doi. 10.1186/s13065-015-0134-z

By:

Derricott, Caitlin E.;
Knight, Emily A.;
Acree Jr., William E.;
Lang, Andrew SID

Publication type:

Article

Predicting Abraham model solvent coefficients.

Published in:

Chemistry Central Journal, 2015, v. 9, n. 1, p. 1, doi. 10.1186/s13065-015-0085-4

By:

Bradley, Jean-Claude;
Abraham, Michael H.;
Acree Jr., William E.;
Lang, Andrew S. I. D.

Publication type:

Article

Determination of Abraham model solute descriptors for the monomeric and dimeric forms of trans-cinnamic acid using measured solubilities from the Open Notebook Science Challenge.

Published in:

Chemistry Central Journal, 2015, v. 9, n. 1, p. 1, doi. 10.1186/s13065-015-0080-9

By:

Bradley, Jean-Claude;
Abraham, Michael H.;
Acree Jr., William E.;
Lang, Andrew S. I. D.;
Beck, Samantha N.;
Bulger, David A.;
Clark, Elizabeth A.;
Condron, Lacey N.;
Costa, Stephanie T.;
Curtin, Evan M.;
Kurtu, Sozit B.;
Mangir, Mark I.;
McBride, Matthew J.

Publication type:

Article

Solubility prediction of anthracene in nonaqueous solvent mixtures using a combination of Jouyban-Acree and Abraham models.

Published in:

Canadian Journal of Chemistry, 2006, v. 84, n. 6, p. 874, doi. 10.1139/V06-082

By:

Jouyban, Abolghasem;
Khoubnasabjafari, Maryam;
Acree Jr., William E.

Publication type:

Article

Solubility of crystalline nonelectrolyte solutes in organic solvents — Mathematical correlation of 2-methoxybenzoic acid and 4-methoxybenzoic acid solubilities with the Abraham solvation parameter model.

Published in:

Canadian Journal of Chemistry, 2004, v. 82, n. 9, p. 1353, doi. 10.1139/V04-112

By:

Hoover, Kaci R.;
Stovall, Dawn M.;
Pustejovsky, Eric;
Coaxum, Rodrick;
Pop, Krisztina;
Acree Jr., William E.;
Abraham, Michael H.

Publication type:

Article

Thermochemical behavior of dissolved carboxylic acid solutes: Solubilities of 3-methylbenzoic acid and 4-chlorobenzoic acid in organic solvents.

Published in:

Canadian Journal of Chemistry, 2003, v. 81, n. 12, p. 1492, doi. 10.1139/v03-169

By:

Daniels, Charlisa R.;
Charlton, Amanda K.;
Wold, Rhiannon M.;
Acree Jr., William E.;
Abraham, Michael H.

Publication type:

Article

Solubility predictions for crystalline nonelectrolyte solutes dissolved in organic solvents based upon the Abraham general solvation model.

Published in:

Canadian Journal of Chemistry, 2001, v. 79, n. 10, p. 1466, doi. 10.1139/cjc-79-10-1466

By:

Acree Jr., William E;
Abraham, Michael H

Publication type:

Article

Reference materials for phase equilibrium studies. 2. Solid–liquid equilibria (IUPAC Technical Report).

Published in:

Pure & Applied Chemistry, 2022, v. 94, n. 11/12, p. 1225, doi. 10.1515/pac-2021-1002

By:

Bazyleva, Ala;
Acree Jr., William E.;
Diky, Vladimir;
Hefter, Glenn T.;
Jacquemin, Johan;
Magalhães, M. Clara F.;
Magee, Joseph W.;
Nordstrom, D. Kirk;
O'Connell, John P.;
Olson, James D.;
Polishuk, Ilya;
Schmidt, Kurt A. G.;
Shaw, John M.;
Trusler, J. P. Martin;
Weir, Ronald D.

Publication type:

Article

Henry's law constants (IUPAC Recommendations 2021).

Published in:

Pure & Applied Chemistry, 2022, v. 94, n. 1, p. 71, doi. 10.1515/pac-2020-0302

By:

Sander, Rolf;
Acree Jr., William E.;
De Visscher, Alex;
Schwartz, Stephen E.;
Wallington, Timothy J.

Publication type:

Article

Reference materials for phase equilibrium studies. 1. Liquid–liquid equilibria (IUPAC Technical Report).

Published in:

Pure & Applied Chemistry, 2021, v. 93, n. 7, p. 811, doi. 10.1515/pac-2020-0905

By:

Bazyleva, Ala;
Acree Jr., William E.;
Chirico, Robert D.;
Diky, Vladimir;
Hefter, Glenn T.;
Jacquemin, Johan;
Magee, Joseph W.;
O'Connell, John P.;
Olson, James D.;
Polishuk, Ilya;
Schmidt, Kurt A. G.;
Shaw, John M.;
Trusler, J. P. Martin;
Weir, Ronald D.

Publication type:

Article