Thermodynamics Research Center / ThermoML | Journal of Chemical Thermodynamics

Experimental measurement and correlation of solubility of ethosuximide in supercritical carbon dioxide

Zha, Xianjun, Han, Sai, Wang, Weifang, Jiao, Zhen
J. Chem. Thermodyn. 2019, 131, 104-110
ABSTRACT
Ethosuximide is a succinimide anticonvulsant active pharmaceutical ingredient. A simple static method by determining the cloud point pressure is employed to measure the solubility of ethosuximide in supercritical carbon dioxide (SC-CO2) at various temperatures T/K = (313.15, 318.15, 323.15 and 328.15) and in pressures P/MPa = (9-15). The experimental solubility of ethosuximide in SC-CO2 is found to be between 3.45E-03 and 8.71E-03 in terms of mole fraction under the experimental conditions. The measured solubility data are successfully correlated by four semi-empirical models including Chrastil, Bartle et al., Kumar and Johnston (K-J) and Mendez-Santiago-Teja (MST). The correlation results show good agreement with the experimental data. The average absolute relative deviation (AARD) between the measured values and the calculated ones are 2.64%, 2.98%, 3.02% and 3.25% for Chrastil, Bartle, K-J and MST respectively. The results of this study provide the effective fundamental for the probable processes based on SC-CO2.
Compounds
# Formula Name
1 CO2 carbon dioxide
2 C7H11NO2 Ethosuximide
Datasets
The table above is generated from the ThermoML associated json file (link above). POMD and RXND refer to PureOrMixture and Reaction Datasets. The compound numbers are included in properties, variables, and phases, if specificied; the numbers refer to the table of compounds on the left.
Type Compound-# Property Variable Constraint Phase Method #Points
  • POMD
  • 2
  • Normal melting temperature, K ; Crystal
  • Crystal
  • Liquid
  • Air at 1 atmosphere
  • DTA
  • 1
  • POMD
  • 1
  • 2
  • Vapor or sublimation pressure, kPa ; Fluid (supercritical or subcritical phases)
  • Temperature, K; Fluid (supercritical or subcritical phases)
  • Mole fraction - 2; Fluid (supercritical or subcritical phases)
  • Fluid (supercritical or subcritical phases)
  • Liquid - 2
  • Closed cell (Static) method
  • 32