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

Measurement and Correlation of CO2 Solubility in 1-Ethyl-3-methylimidazolium ([EMIM]) Cation-Based Ionic Liquids: [EMIM][Ac], [EMIM][Cl], and [EMIM][MeSO4]

Yim, Joon-Hyuk, Ha, Seung-Jae, Lim, Jong Sung
J. Chem. Eng. Data 2018, 63, 3, 508-518
ABSTRACT
The solubility of carbon dioxide (CO2) was investigated using three different 1-ethyl-3methylimidazolium ([EMIM]) cation based ionic liquids: 1-ethyl-3-methylimidazolium acetate ([EMIM][Ac]), 1-ethyl-3-methylimidazolium chloride ([EMIM][Cl]), 1-ethyl-3methylimidazolium methyl sulfate ([EMIM][MeSO4]). The CO2 solubility data in the three ionic liquids was produced by measuring the bubble point and cloud point pressures of the CO2 + ionic liquid mixtures. The temperature range was from 303.15 to 403.15 K and the pressure range was from 0.45 to 48.6 MPa. The experimental data provided results showing that the solubility of CO2 in ionic liquids increased with pressure, decreased with temperature, and was also affected by the different anions used in the experiment. The solubility is determined by CO2 mole fraction in ionic liquids, and the order of magnitude of the CO2 solubility was found to be [EMIM][Ac] greater than [EMIM][MeSO4] greater than [EMIM][Cl]. For the correlation and calculation of the experimental data, we used: the Peng-Robinson equation of state (PR-EoS), the conventional van der Waals one fluid mixing rule and the modified Lydersen-Joback-Reid method. The average absolute deviations of pressure (AADP) were 0.0231 for CO2 + [EMIM][Ac], 0.0141 for CO2 + [EMIM][Cl], and 0.0275 for CO2 + [EMIM][MeSO4] systems.
Compounds
# Formula Name
1 CO2 carbon dioxide
2 C8H14N2O2 1-ethyl-3-methylimidazolium acetate
3 C6H11ClN2 1-ethyl-3-methylimidazolium chloride
4 C7H14N2O4S 1-ethyl-3-methylimidazolium methylsulfate
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
  • 1
  • Vapor or sublimation pressure, kPa ; Liquid
  • Mole fraction - 1; Liquid
  • Temperature, K; Liquid
  • Liquid
  • Gas
  • Closed cell (Static) method
  • 62
  • POMD
  • 2
  • 1
  • Vapor or sublimation pressure, kPa ; Liquid mixture 1
  • Temperature, K; Liquid mixture 1
  • Mole fraction - 1; Liquid mixture 1
  • Liquid mixture 1
  • Liquid mixture 2
  • Closed cell (Static) method
  • 2
  • POMD
  • 3
  • 1
  • Vapor or sublimation pressure, kPa ; Liquid
  • Mole fraction - 1; Liquid
  • Temperature, K; Liquid
  • Liquid
  • Gas
  • Closed cell (Static) method
  • 39
  • POMD
  • 3
  • 1
  • Vapor or sublimation pressure, kPa ; Liquid mixture 1
  • Mole fraction - 1; Liquid mixture 1
  • Temperature, K; Liquid mixture 1
  • Liquid mixture 1
  • Liquid mixture 2
  • Closed cell (Static) method
  • 9
  • POMD
  • 4
  • 1
  • Vapor or sublimation pressure, kPa ; Liquid
  • Mole fraction - 1; Liquid
  • Temperature, K; Liquid
  • Liquid
  • Gas
  • Closed cell (Static) method
  • 48
  • POMD
  • 4
  • 1
  • Vapor or sublimation pressure, kPa ; Liquid mixture 1
  • Mole fraction - 1; Liquid mixture 1
  • Temperature, K; Liquid mixture 1
  • Liquid mixture 1
  • Liquid mixture 2
  • Closed cell (Static) method
  • 16