Thermodynamics Research Center / ThermoML | Journal of Chemical and Engineering Data

Effect of Solvent Composition and Temperature on the Solubility of Ibuprofen in Aqueous Ethanol

Rashid, A.[Abdur], White, E.[Edward], Howes, T.[Tony], Litster, J. D.[James D.], Marziano, I.[Ivan]
J. Chem. Eng. Data 2014, 59, 9, 2699-2703
ABSTRACT
The solubilities of ibuprofen [(R,S)-2-(4-(2-methylpropyl)phenyl)propanoic acid] in absolute ethanol and in water ethanol mixtures were measured at temperatures from 10 deg C to 40 deg C, the expected range relevant to its industrial crystallization. The solubility studies were carried out by dissolution of ibuprofen crystals in stirred Schott bottles kept in a constant temperature bath. The ibuprofen concentration in the clear supernatant at equilibrium was determined by vacuum drying. An allowance was made for the small amount of sublimation from dried ibuprofen. In absolute ethanol, the experimental results showed that the solubility increased as a square law with temperature, from 0.59 g of ibuprofen/g ethanol at 10.0 deg C to 2.15 g/g at 40.0 deg C. The results are considered to be accurate to within +-1% (as 95% confidence). In water ethanol mixtures, the solubility of ibuprofen (expressed as w/w ibuprofen/solvent) generally decreased with increasing water addition. At 40 deg C and possibly at 25 deg C, the solubility initially increased slightly to a maximum level as a small amount of water was added before then decreasing. At 40 deg C, phase separation into two immiscible liquid layers was observed for solvent concentrations from 34 to 64% ethanol on an ibuprofen-free basis.
Compounds
# Formula Name
1 C13H18O2 ibuprofen
2 H2O water
3 C2H6O ethanol
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
  • 1
  • Mass fraction - 1 ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Liquid
  • Crystal - 1
  • Gravimetric
  • 6
  • POMD
  • 3
  • 2
  • 1
  • Mass fraction - 1 ; Liquid
  • Temperature, K; Liquid
  • Solvent: Mass fraction - 2; Liquid
  • Pressure, kPa; Liquid
  • Liquid
  • Crystal - 1
  • Gravimetric
  • 30