Thermodynamics Research Center / ThermoML | Journal of Chemical Thermodynamics

Correlation and thermodynamic analysis of solubility of cefmetazole acid in three (alcohol + water) binary solvents at temperatures from 278.15 K to 303.15 K

Sun, M.[Mengmeng], Li, K.[Kangli], Du, S.[Shichao], Liu, Y.[Yumin], Han, D.[Dandan], Li, X.[Xiaona], Yang, P.[Peng], Liu, S.[Shiyuan], Gong, J.[Junbo]
J. Chem. Thermodyn. 2016, 103, 355-365
ABSTRACT
The solubility of cefmetazole acid in binary solvent mixtures, (methanol + water), (ethanol + water) and (isopropanol + water), was determined by UV spectroscopic method at temperatures from 278.15 to 303.15 K. The solubility of cefmetazole acid increased with the increase of temperature in all solvents. In (methanol + water) co-solvent mixture, the solubility of cefmetazole acid is maximal in neat methanol. In (ethanol + water) and (isopropanol + water) solvent mixtures, the solubility of cefmetazole acid reaches its maximum when the mole fraction of alcohol is 0.5 and 0.4, respectively. The modified Apelblat equation, the CNIBS/R-K model and the Jouyban Acree model were applied to correlate the experimental solubility of cefmetazole acid. Moreover, the activity coefficients as well as the thermodynamic properties of mixing were calculated and discussed based on the NRTL model and experimental solubility values.
Compounds
# Formula Name
1 C15H17N7O5S3 Cefmetazole
2 H2O water
3 CH4O methanol
4 C2H6O ethanol
5 C3H8O propan-2-ol
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
  • 3
  • 2
  • 1
  • Mole fraction - 1 ; Liquid
  • Temperature, K; Liquid
  • Solvent: Mole fraction - 3; Liquid
  • Pressure, kPa; Liquid
  • Liquid
  • Crystal - 1
  • UV Spectrophotometry
  • 54
  • POMD
  • 4
  • 2
  • 1
  • Mole fraction - 1 ; Liquid
  • Temperature, K; Liquid
  • Solvent: Mole fraction - 4; Liquid
  • Pressure, kPa; Liquid
  • Liquid
  • Crystal - 1
  • UV Spectrophotometry
  • 54
  • POMD
  • 5
  • 2
  • 1
  • Mole fraction - 1 ; Liquid
  • Temperature, K; Liquid
  • Solvent: Mole fraction - 5; Liquid
  • Pressure, kPa; Liquid
  • Liquid
  • Crystal - 1
  • UV Spectrophotometry
  • 54
  • POMD
  • 3
  • 1
  • Mole fraction - 1 ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Liquid
  • Crystal - 1
  • UV Spectrophotometry
  • 6
  • POMD
  • 4
  • 1
  • Mole fraction - 1 ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Liquid
  • Crystal - 1
  • UV Spectrophotometry
  • 6