Thermodynamics Research Center / ThermoML | Fluid Phase Equilibria

Effect of bis(trifluoromethylsulfonyl)imide-based ionic liquids on the isobaric vapor - liquid equilibrium behavior of ethanol + dimethyl carbonate at 101.3 kPa

Qiao, Ruiqi, Yue, Kun, Luo, Chengjingyan, Jin, Junsu, Ren, Zhongqi, Li, Qunsheng
Fluid Phase Equilib. 2018, 472, 212-217
ABSTRACT
Isobaric vapor - liquid equilibrium (VLE) data for the binary system of ethanol + dimethyl carbonate (DMC) and the ternary systems of ethanol + DMC + 1-hexyl-3-methylimidazolium bis[(trifluoromethyl) sulfonyl] imide ([HMIM][NTf2]) and ethanol + DMC + 1-butyl-3-methylimidazolium bis[(trifluoromethyl) sulfonyl] imide ([BMIM][NTf2]) were obtained by using a modified Othmer still at a constant pressure of 101.3 kPa. The experimental results indicated that both [HMIM][NTf2] and [BMIM][NTf2] had a notable effect on the azeotropic system of ethanol - DMC. The NRTL model was used in this work to correlate VLE data and the calculated data agreed well with the experimental value. The minimum mole fractions of [HMIM][NTf2] and [BMIM][NTf2] needed to eliminate azeotrope were 0.125 and 0.170 calculated by NRTL model, respectively. And the [HMIM][NTf2] was found to be a better candidate of entrainer for separating the ethanol - DMC azeotrope.
Compounds
# Formula Name
1 C2H6O ethanol
2 C3H6O3 dimethyl carbonate
3 C12H19F6N3O4S2 1-hexyl-3-methylimidazolium bis[(trifluoromethyl)sulfonyl]imide
4 C10H15F6N3O4S2 1-butyl-3-methylimidazolium bis(trifluoromethylsulfonyl)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
  • Boiling temperature at pressure P, K ; Liquid
  • Mole fraction - 1; Liquid
  • Pressure, kPa; Liquid
  • Liquid
  • Gas
  • Ebulliometric method (Recirculating still)
  • 19
  • POMD
  • 1
  • 2
  • Mole fraction - 1 ; Gas
  • Mole fraction - 1; Liquid
  • Pressure, kPa; Gas
  • Gas
  • Liquid
  • Chromatography
  • 19
  • POMD
  • 1
  • 2
  • 3
  • Boiling temperature at pressure P, K ; Liquid
  • Mole fraction - 1; Liquid
  • Mole fraction - 3; Liquid
  • Pressure, kPa; Liquid
  • Liquid
  • Gas
  • Ebulliometric method (Recirculating still)
  • 30
  • POMD
  • 1
  • 2
  • 3
  • Mole fraction - 1 ; Gas
  • Mole fraction - 1; Liquid
  • Mole fraction - 3; Liquid
  • Pressure, kPa; Gas
  • Gas
  • Liquid
  • Chromatography
  • 30
  • POMD
  • 1
  • 2
  • 3
  • Mole fraction - 3 ; Gas
  • Mole fraction - 1; Liquid
  • Mole fraction - 3; Liquid
  • Pressure, kPa; Gas
  • Gas
  • Liquid
  • Assumed that ionic liquid is non-volatile
  • 30
  • POMD
  • 1
  • 2
  • 4
  • Boiling temperature at pressure P, K ; Liquid
  • Mole fraction - 1; Liquid
  • Mole fraction - 4; Liquid
  • Pressure, kPa; Liquid
  • Liquid
  • Gas
  • Ebulliometric method (Recirculating still)
  • 30
  • POMD
  • 1
  • 2
  • 4
  • Mole fraction - 1 ; Gas
  • Mole fraction - 1; Liquid
  • Mole fraction - 4; Liquid
  • Pressure, kPa; Gas
  • Gas
  • Liquid
  • Chromatography
  • 30
  • POMD
  • 1
  • 2
  • 4
  • Mole fraction - 4 ; Gas
  • Mole fraction - 1; Liquid
  • Mole fraction - 4; Liquid
  • Pressure, kPa; Gas
  • Gas
  • Liquid
  • Assumed that ionic liquid is non-volatile
  • 30