Abstract
The solubility of a solid in a liquid for organic systems has been modeled using thermodynamic principles. The possibility of estimating average solvation and self-association parameters allows the activity coefficients calculated for the liquid phase equilibrated with the solid phase to be carried over to the solubility problem.
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Serafimov, L.A., Frolkova, A.K., and Chelyuskina, T.V., Selecting extracting agents for separation of biazeotropic binary mixtures by extractive distillation, Teor. Found. Chem. Eng., 2009, vol. 43, pp. 889–898.
Serafimov, L.A., Frolkova, A.K., and Bushina, D.I., Extractive distillation of binary azeotropic mixtures, Theor. Found. Chem. Eng., 2008, vol. 42, pp. 507–516.
Long, B., Li, J., Zhang, R., and Wan, L., Solubility of benzoic acid in acetone, 2-propanol, acetic acid and cyclohexane: experimental measurement and thermodynamic modeling, Fluid Phase Equilib., 2010, vol. 297, pp. 113–121.
Prausnitz, J.M. and Tavares, F.W., Thermodynamics of fluid-phase equilibria for standard chemical engineering operations, AIChE J., 2004, vol. 50, pp. 739–761.
Mullin, J.W., Crystallization, Oxford: ButterworthHeinemann, 2001, 4th ed.
Modarresi, H., Conte, E., Abildskov, J., Gani, R., and Crafts, P., Model-based calculation of solid solubility for solvent selection-a review, Ind. Eng. Chem. Res., 2008, vol. 47, pp. 5234–5242.
O’Connell, J.P., Gani, R., Mathias, P.M., Maurer, G., Olson, J.D., and Crafts, P.A., Thermodynamic property modeling for chemical process and product engineering: some perspectives, Ind. Eng. Chem. Res., 2009, vol. 48, pp. 4619–4637.
Walas, S., Phase Equilibria in Chemical Engineering, London: Butterworth, 1985.
Buchowski, H., Ksiazczak, A., and Pietrzyk, S., Solvent activity along a saturation line and solubility of hydrogen-bonding solids, J. Phys. Chem., 1980, vol. 84, pp. 975–979.
Long, B. and Yang, Z., Measurements of the solubilities of m-phthalic acid in acetone, ethanol and acetic ether, Fluid Phase Equilib., 2008, vol. 266, pp. 38–41.
Long, B., Wang, Y., and Yang, Z., Partition behavior of benzoic acid in (water + n-dodecane) solutions at t = (293.15 and 298.15) K, J. Chem. Thermodyn., 2008, vol. 40, pp. 1565–1568.
Domanska, U., Vapor-liquid-solid equilibrium of eicosanoic acid in oneand two-component solvents, Fluid Phase Equilib., 1986, vol. 26, pp. 201–220.
Esina, Z.N., Korchuganova, M.R., and Murashkin, V.V., Mathematical modeling of the liquid-solid phase transition, Vestn. Tomsk. Gos. Univ. Upravl., Vychisl. Tekh. Inform., 2011, no. 3, pp. 13–23.
Esina, Z.N., Matematicheskoe modelirovanie fazovykh perekhodov v real’nykh rastvorakh (Mathematical Modeling of Phase Transitions in Real Solutions), Kemerovo: Kemerov. Gos. Univ., 2011.
Esina, Z.N., RF Inventor’s Certificate no. 2012620983, 2012.
Kogan, V.B., Geterogennye ravnovesiya (Heterogeneous Equilibria), Leningrad: Khimiya, 1968.
Stephen, H. and Stephen, T., Solubilities of Inorganic and Organic Compounds, Oxford: Pergamon, 1963, vol. 1.
Yalkovsky, S.H. and He, Y., Handbook of Aqueous Solubility Data, Boca Raton, Fla.: CRC, 2003.
Jouyban, A., Handbook of Solubility Data for Pharmaceuticals, Boca Raton, Fla.: CRC, 2009.
Beerbower, A., Wu, P., and Martin, A., Expanded solubility parameter approach. I: Naphthalene and benzoic acid in individual solvents, J. Pharm. Sci., 2008, vol. 73, pp. 179–188.
Perlovich, G.L. and Brandl-Bauer, A., Thermodynamics of solutions. I: Benzoic acid and acetylsalicylic acid as models for drug substances and the prediction of solubility, Pharm. Res., 2003, vol. 20, pp. 471–478.
Jia, Q., Ma, P., Yi, S., Wang, Q., Wang, C., and Li, G., Solubilities of benzoic acid, p-methylbenzoic acid, m-methylbenzoic acid, o-methylbenzoic acid, p-hydroxybenzoic acid, and o-nitrobenzoic acid in 1-octanol, J. Chem. Eng. Data, 2008, vol. 53, pp. 1278–1282.
Pires, R.F. and Franco, Jr., M.R., Solubility of benzoic acid in aqueous solutions containing ethanol or n-propanol, J. Chem. Eng. Data, 2008, vol. 53, pp. 2704–2706.
Oliveira, A.C., Coelho, M.G., Pires, R.F., and Franco, M.R., Jr., Solubility of benzoic acid in mixed solvents, J. Chem. Eng. Data, 2007, vol. 52, pp. 298–300.
Wang, Q., Hou, L., Cheng, Y., and Li, X., Solubilities of benzoic acid and phthalic acid in acetic acid plus water solvent mixtures, J. Chem. Eng. Data, 2007, vol. 52, pp. 936–940.
Ma, P. and Xia, Q., Determination and correlation for solubility of aromatic acids in solvents, Chin. J. Chem. Eng., 2001, vol. 9, pp. 39–44.
Burger, K., Solvation, Ionic, and Complex Formation Reactions in Non-Aqueous Solvents: Experimental Methods for Their Investigation, Amsterdam: Elsevier, 1983.
Peng, C., Liu, P., and Hu, Y., Solid-liquid equilibria based on an equation of state for chain fluids, Fluid Phase Equilib., 2001, vol. 180, pp. 299–311.
Gmehling, J.G., Anderson, T.F., and Prausnitz, J.M., Solid-liquid equilibria using UNIFAC, Ind. Eng. Chem. Fundam., 1978, vol. 17, pp. 269–273.
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Original Russian Text © Z.N. Esina, M.R. Korchuganova, 2015, published in Teoreticheskie Osnovy Khimicheskoi Tekhnologii, 2015, Vol. 49, No. 3, pp. 329–338.
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Esina, Z.N., Korchuganova, M.R. Modeling of the solubility of a solid in a liquid for organic systems. Theor Found Chem Eng 49, 313–321 (2015). https://doi.org/10.1134/S0040579515030021
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DOI: https://doi.org/10.1134/S0040579515030021