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

Solubility of Ionic Liquid [Bmim]Ac in Supercritical CO2 Containing Different Cosolvents

Li, Gen, Zhou, Dan, Xu, Qin-Qin, Qiao, Guo-Yue, Yin, Jian-Zhong
J. Chem. Eng. Data 2018, 63, 5, 1596-1602
ABSTRACT
The solubility of ionic liquid (IL) 1-butyl-3-methylimidazolium acetate ([Bmim]Ac) in supercritical carbon dioxide (scCO2) with cosolvents, including ethanol, acetone, dimethylsulfoxide (DMSO) and acetonitrile, was determined respectively at 40 C, 50 C, 60 C and pressure up to 15.0 MPa. The results showed that the addition of cosolvents has a significant effect on the solubility of [Bmim]Ac in scCO2. The ability of different cosolvents to enhance the solubility of [Bmim]Ac in scCO2 are in the following order: ethanol greater than DMSO greater than acetone greater than acetonitrile. The solubility of [Bmim]Ac in scCO2 / cosolvent mixture increased dramatically as the cosolvent concentration exceeded 20.0 mol%. The effect of temperature on solubility is more complicated: The solubility of [Bmim]Ac in scCO2 / cosolvent increased slowly when using ethanol as cosolvent, but decreased slowly when using acetone or acetonitrile as cosolvent, and increased first and then decreased when using DMSO as cosolvent as the temperature increased from (40 to 50, 60) . Moreover, the values of solubility increased as the pressure increased from (8 to 15) MPa. The increase tendency in the high pressure area is more obvious. The maximum solubility is 3.66x10-4 mol%, which can be obtained when using 26.0 mol% ethanol at 60 , 14.55 MPa and the minimum solubility is 1.89x10-6 mol%, which can be obtained when using 10.5 mol% DMSO at 40 , 9.93 MPa. The modified Christal equation was used to correlate the solubility data, and the average absolute relative deviations are in the range of 4.36%-14.35%, the maximum correlation accuracy is obtained when using ethanol as cosolvent, a minimum value for system using DMSO as cosolvent.
Compounds
# Formula Name
1 CO2 carbon dioxide
2 C10H18N2O2 1-butyl-3-methylimidazolium acetate
3 C8H15F6N2P 1-butyl-3-methylimidazolium hexafluorophosphate
4 C2H6O ethanol
5 C3H6O acetone
6 C2H6OS dimethyl sulfoxide
7 C2H3N acetonitrile
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
  • 4
  • 1
  • Vapor or sublimation pressure, kPa ; Fluid (supercritical or subcritical phases)
  • Mole fraction - 4; Fluid (supercritical or subcritical phases)
  • Mole fraction - 3; Fluid (supercritical or subcritical phases)
  • Temperature, K; Fluid (supercritical or subcritical phases)
  • Fluid (supercritical or subcritical phases)
  • Liquid
  • Closed cell (Static) method
  • 5
  • POMD
  • 2
  • 4
  • 1
  • Vapor or sublimation pressure, kPa ; Fluid (supercritical or subcritical phases)
  • Temperature, K; Fluid (supercritical or subcritical phases)
  • Mole fraction - 4; Fluid (supercritical or subcritical phases)
  • Mole fraction - 2; Fluid (supercritical or subcritical phases)
  • Fluid (supercritical or subcritical phases)
  • Liquid
  • Closed cell (Static) method
  • 60
  • POMD
  • 2
  • 5
  • 1
  • Vapor or sublimation pressure, kPa ; Fluid (supercritical or subcritical phases)
  • Temperature, K; Fluid (supercritical or subcritical phases)
  • Mole fraction - 5; Fluid (supercritical or subcritical phases)
  • Mole fraction - 2; Fluid (supercritical or subcritical phases)
  • Fluid (supercritical or subcritical phases)
  • Liquid
  • Closed cell (Static) method
  • 45
  • POMD
  • 2
  • 6
  • 1
  • Vapor or sublimation pressure, kPa ; Fluid (supercritical or subcritical phases)
  • Temperature, K; Fluid (supercritical or subcritical phases)
  • Mole fraction - 6; Fluid (supercritical or subcritical phases)
  • Mole fraction - 2; Fluid (supercritical or subcritical phases)
  • Fluid (supercritical or subcritical phases)
  • Liquid
  • Closed cell (Static) method
  • 60
  • POMD
  • 2
  • 7
  • 3
  • Vapor or sublimation pressure, kPa ; Fluid (supercritical or subcritical phases)
  • Temperature, K; Fluid (supercritical or subcritical phases)
  • Mole fraction - 7; Fluid (supercritical or subcritical phases)
  • Mole fraction - 2; Fluid (supercritical or subcritical phases)
  • Fluid (supercritical or subcritical phases)
  • Liquid
  • Closed cell (Static) method
  • 60
  • POMD
  • 3
  • 1
  • Vapor or sublimation pressure, kPa ; Fluid (supercritical or subcritical phases)
  • Mole fraction - 3; Fluid (supercritical or subcritical phases)
  • Temperature, K; Fluid (supercritical or subcritical phases)
  • Fluid (supercritical or subcritical phases)
  • Liquid
  • Closed cell (Static) method
  • 1