TY - JOUR
T1 - Thermodynamic models for determination of the solubility of 4-(4-aminophenyl)-3-morpholinone in different pure solvents and (1,4-dioxane + ethyl acetate) binary mixtures with temperatures from (278.15 to 333.15) K
AU - Yang, Wenge
AU - Fan, Shimin
AU - Guo, Qirun
AU - Hao, Jianfeng
AU - Li, Hongjie
AU - Yang, Shouhai
AU - Zhao, Wangdan
AU - Zhang, Jian
AU - Hu, Yonghong
N1 - Publisher Copyright:
© 2016 Elsevier Ltd. All rights reserved.
PY - 2016/6/1
Y1 - 2016/6/1
N2 - A gravimetric method was used to measure the solubility of the 4-(4-Aminophenyl)-3-morpholinone under atmospheric pressure in 1,4-dioxane, methanol, tetrahydrofuran, ethanol, ethyl acetate, n-propanol as well as in the (1,4-dioxane + ethyl acetate) binary mixtures from T = (278.15 to 333.15) K. The experiment results have proved that rising temperature leads to increased solubility of the 4-(4-aminophenyl)-3-morpholinone in all selected solvents. The (solid + liquid) equilibrium data in six pure solvents and binary mixtures were correlated with four equations, including the modified Apelblat equation, the Buchowski-Ksiazaczak λh equation, CNIBS/R-K equation and the Jouyban-Acree equation. During the research, the computational values were in good agreement with the experimental results according to the calculations based on all selected equations, and the modified Apelblat equation stood out to be the higher suitable with the higher accuracy. The thermodynamic properties of the solution process, including the Gibbs energy, enthalpy, and entropy were calculated by the van't Hoff analysis. All values of %ξH are ≥60.35% indicated that in each studied solvent the dissolution process of 4-(4-aminophenyl)-3-morpholinone is endothermic.
AB - A gravimetric method was used to measure the solubility of the 4-(4-Aminophenyl)-3-morpholinone under atmospheric pressure in 1,4-dioxane, methanol, tetrahydrofuran, ethanol, ethyl acetate, n-propanol as well as in the (1,4-dioxane + ethyl acetate) binary mixtures from T = (278.15 to 333.15) K. The experiment results have proved that rising temperature leads to increased solubility of the 4-(4-aminophenyl)-3-morpholinone in all selected solvents. The (solid + liquid) equilibrium data in six pure solvents and binary mixtures were correlated with four equations, including the modified Apelblat equation, the Buchowski-Ksiazaczak λh equation, CNIBS/R-K equation and the Jouyban-Acree equation. During the research, the computational values were in good agreement with the experimental results according to the calculations based on all selected equations, and the modified Apelblat equation stood out to be the higher suitable with the higher accuracy. The thermodynamic properties of the solution process, including the Gibbs energy, enthalpy, and entropy were calculated by the van't Hoff analysis. All values of %ξH are ≥60.35% indicated that in each studied solvent the dissolution process of 4-(4-aminophenyl)-3-morpholinone is endothermic.
KW - CNIBS/R-K equation
KW - Intermediate of rivaroxaban
KW - Jouyban-Acree equation
KW - Modified Apelblat equation
KW - van't Hoff equation
UR - http://www.scopus.com/inward/record.url?scp=84958770224&partnerID=8YFLogxK
U2 - 10.1016/j.jct.2016.01.022
DO - 10.1016/j.jct.2016.01.022
M3 - 文章
AN - SCOPUS:84958770224
SN - 0021-9614
VL - 97
SP - 214
EP - 220
JO - Journal of Chemical Thermodynamics
JF - Journal of Chemical Thermodynamics
ER -