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

High-Pressure Vapor[?]Liquid Equilibria of 1-Alkyl-1-Methylpyrrolidinium Bis(trifluoromethylsulfonyl)imide Ionic Liquids and CO2

Turnaoglu, T.[Tugba], Minnick, D. L.[David L.], Morais, A. R. C.[Ana Rita C.], Baek, D. L.[Donna L.], Fox, R. V.[Robert V.], Scurto, A. M.[Aaron M.], Shiflett, M. B.[Mark B.]
J. Chem. Eng. Data 2019, 64, 11, 4668-4678
ABSTRACT
The high-pressure vapor-liquid equilibrium for the binary systems of carbon dioxide (CO2) and a series of 1-alkyl-1-methyl pyrrolidinium bis(trifluoromethylsulfonyl)imide ionic liquids ([CnC1pyr][NTf2] (n = 3,4,6)) are reported at 298.15, 318.15 and 338.15 K and at pressures up to 20 MPa. Experiments were conducted using gravimetric (IGA and XEMIS microbalances) and volumetric (high-pressure view cell) methods. The solubility of CO2 in pyrrolidinium ionic liquids increases with decreasing temperature and increasing pressure. The CO2 solubility also slightly increases with increase in alkyl chain length on the pyrrolidinium cation. Molar volume and volume expansion of CO2 + IL mixtures are also reported. The Fickian diffusion of CO2 in pyrrolidinium based ionic liquids (~10-10 m2*s) was calculated at pressures up to 2 MPa and found to be slightly lower than the diffusivity of CO2 in an imidazolium based ionic liquid with the [NTf2] anion.
Compounds
# Formula Name
1 CO2 carbon dioxide
2 C12H19F6N3O4S2 1-hexyl-3-methylimidazolium bis[(trifluoromethyl)sulfonyl]imide
3 C10H18F6N2O4S2 1-methyl-1-propylpyrrolidinium bis[(trifluoromethyl)sulfonyl]imide
4 C11H20F6N2O4S2 1-butyl-1-methylpyrrolidinium bis[(trifluoromethyl)sulfonyl]imide
5 C13H24F6N2O4S2 1-hexyl-1-methylpyrrolidinium bis(trifluoromethanesulfonyl)imide
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
  • 1
  • 2
  • Mole fraction - 1 ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Liquid
  • Gas
  • Phase equilibration
  • 37
  • POMD
  • 1
  • 3
  • Mole fraction - 1 ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Liquid
  • Gas
  • Phase equilibration
  • 78
  • POMD
  • 1
  • 3
  • Mass density, kg/m3 ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Mole fraction - 1; Liquid
  • Liquid
  • Pycnometric method
  • 27
  • POMD
  • 1
  • 3
  • Mole fraction - 1 ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Liquid
  • Gas
  • Phase equilibration
  • 14
  • POMD
  • 1
  • 3
  • Binary diffusion coefficient, m2/s ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Mole fraction - 1; Liquid
  • Liquid
  • Open capillary
  • 6
  • POMD
  • 1
  • 4
  • Mole fraction - 1 ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Liquid
  • Gas
  • Phase equilibration
  • 75
  • POMD
  • 1
  • 4
  • Mass density, kg/m3 ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Mole fraction - 1; Liquid
  • Liquid
  • Pycnometric method
  • 28
  • POMD
  • 1
  • 4
  • Mole fraction - 1 ; Liquid
  • Pressure, kPa; Liquid
  • Temperature, K; Liquid
  • Liquid
  • Gas
  • Phase equilibration
  • 14
  • POMD
  • 1
  • 4
  • Binary diffusion coefficient, m2/s ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Mole fraction - 1; Liquid
  • Liquid
  • Open capillary
  • 6
  • POMD
  • 1
  • 5
  • Mole fraction - 1 ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Liquid
  • Gas
  • Phase equilibration
  • 74
  • POMD
  • 1
  • 5
  • Mass density, kg/m3 ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Mole fraction - 1; Liquid
  • Liquid
  • Pycnometric method
  • 30
  • POMD
  • 1
  • 5
  • Mole fraction - 1 ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Liquid
  • Gas
  • Phase equilibration
  • 13
  • POMD
  • 1
  • 5
  • Binary diffusion coefficient, m2/s ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Mole fraction - 1; Liquid
  • Liquid
  • Open capillary
  • 6