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

Measurement of Infinite Dilution Activity Coefficients of Alcohols, Ketones, and Aromatic Hydrocarbons in 4-Methyl-N-butylpyridinium Tetrafluoroborate and 1-Butyl-3-methylimidazolium Hexafluorophosphate by Gas-Liquid Chromatography

Shimoyama, Y.[Yusuke], Hirayama, T.[Takeshi], Iwai, Y.[Yoshio]
J. Chem. Eng. Data 2008, 53, 9, 2106-2111
ABSTRACT
The infinite dilution activity coefficients of C1 to C5 alcohols, acetone, 2-butanone, acetylacetone, toluene, and xylene isomers in 4-methyl-N-butylpyridinium tetrafluoroborate ([bmpy][BF4]) and 1-butyl-3-methylimidazolium hexafluorophosphate ([bmim][PF6]) were measured by gas-liquid chromatography (GC) from (306.6 to 334.8) K and atmospheric pressure. In these measurements with GC, [bmpy][BF4] or [bmim][PF6] was used as a stationary phase. The infinite dilution activity coefficients in this work were not affected by the gas flow rate. It was found that the values of 1-propanol, 1-butanol, and 1-pentanol for the infinite dilution activity coefficients in [bmim][PF6] were larger than those for their isomers. For xylene isomers, the activity coefficients of m-xylene are the largest. The effects of the cation and anion species composing ionic liquid on the activity coefficients were also investigated. The activity coefficients for alcohols, ketones, and aromatic hydrocarbons in the ionic liquids were affected by the anion species more strongly than the cation species of the ionic liquid. The partial molar excess enthalpies at infinite dilution for the solutes in ionic liquids were obtained from the temperature dependence of the infinite dilution activity coefficients. Moreover, the partial molar excess entropies were also calculated from the enthalpies. The excess enthalpy and entropy contributions to the activity coefficients in ionic liquid were investigated.
Compounds
# Formula Name
1 CH4O methanol
2 C10H16BF4N 1-butyl-4-methylpyridinium tetrafluoroborate
3 C2H6O ethanol
4 C3H6O acetone
5 C4H8O butanone
6 C8H15F6N2P 1-butyl-3-methylimidazolium hexafluorophosphate
7 C3H8O propan-1-ol
8 C3H8O propan-2-ol
9 C4H10O butan-1-ol
10 C4H10O butan-2-ol
11 C4H10O 2-methyl-1-propanol
12 C5H12O pentan-1-ol
13 C5H12O pentan-2-ol
14 C5H12O 3-pentanol
15 C5H12O 3-methylbutan-1-ol
16 C5H8O2 2,4-pentanedione
17 C7H8 toluene
18 C8H10 1,2-dimethylbenzene
19 C8H10 1,3-dimethylbenzene
20 C8H10 1,4-dimethylbenzene
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
  • Activity coefficient - 1 ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Mole fraction - 1; Liquid
  • Liquid
  • Chromatography
  • 3
  • POMD
  • 3
  • 2
  • Activity coefficient - 3 ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Mole fraction - 3; Liquid
  • Liquid
  • Chromatography
  • 3
  • POMD
  • 4
  • 2
  • Activity coefficient - 4 ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Mole fraction - 4; Liquid
  • Liquid
  • Chromatography
  • 3
  • POMD
  • 5
  • 2
  • Activity coefficient - 5 ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Mole fraction - 5; Liquid
  • Liquid
  • Chromatography
  • 3
  • POMD
  • 1
  • 6
  • Activity coefficient - 1 ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Mole fraction - 1; Liquid
  • Liquid
  • Chromatography
  • 3
  • POMD
  • 3
  • 6
  • Activity coefficient - 3 ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Mole fraction - 3; Liquid
  • Liquid
  • Chromatography
  • 3
  • POMD
  • 7
  • 6
  • Activity coefficient - 7 ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Mole fraction - 7; Liquid
  • Liquid
  • Chromatography
  • 3
  • POMD
  • 8
  • 6
  • Activity coefficient - 8 ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Mole fraction - 8; Liquid
  • Liquid
  • Chromatography
  • 3
  • POMD
  • 9
  • 6
  • Activity coefficient - 9 ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Mole fraction - 9; Liquid
  • Liquid
  • Chromatography
  • 3
  • POMD
  • 10
  • 6
  • Activity coefficient - 10 ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Mole fraction - 10; Liquid
  • Liquid
  • Chromatography
  • 3
  • POMD
  • 11
  • 6
  • Activity coefficient - 11 ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Mole fraction - 11; Liquid
  • Liquid
  • Chromatography
  • 3
  • POMD
  • 12
  • 6
  • Activity coefficient - 12 ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Mole fraction - 12; Liquid
  • Liquid
  • Chromatography
  • 3
  • POMD
  • 13
  • 6
  • Activity coefficient - 13 ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Mole fraction - 13; Liquid
  • Liquid
  • Chromatography
  • 3
  • POMD
  • 14
  • 6
  • Activity coefficient - 14 ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Mole fraction - 14; Liquid
  • Liquid
  • Chromatography
  • 3
  • POMD
  • 15
  • 6
  • Activity coefficient - 15 ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Mole fraction - 15; Liquid
  • Liquid
  • Chromatography
  • 3
  • POMD
  • 4
  • 6
  • Activity coefficient - 4 ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Mole fraction - 4; Liquid
  • Liquid
  • Chromatography
  • 3
  • POMD
  • 5
  • 6
  • Activity coefficient - 5 ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Mole fraction - 5; Liquid
  • Liquid
  • Chromatography
  • 3
  • POMD
  • 16
  • 6
  • Activity coefficient - 16 ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Mole fraction - 16; Liquid
  • Liquid
  • Chromatography
  • 3
  • POMD
  • 17
  • 6
  • Activity coefficient - 17 ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Mole fraction - 17; Liquid
  • Liquid
  • Chromatography
  • 3
  • POMD
  • 18
  • 6
  • Activity coefficient - 18 ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Mole fraction - 18; Liquid
  • Liquid
  • Chromatography
  • 3
  • POMD
  • 19
  • 6
  • Activity coefficient - 19 ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Mole fraction - 19; Liquid
  • Liquid
  • Chromatography
  • 3
  • POMD
  • 20
  • 6
  • Activity coefficient - 20 ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Mole fraction - 20; Liquid
  • Liquid
  • Chromatography
  • 3