Thermodynamics Research Center / ThermoML | Journal of Chemical Thermodynamics

Excess molar volumes and excess isentropic compressibilities of ternary mixtures containing ionic liquids and cyclic alkanone

Gupta, H.[Heena], Malik, S.[Sunita], Sharma, V. K.[Vinod Kumar]
J. Chem. Thermodyn. 2017, 112, 86-102
ABSTRACT
This paper reports densities, qijk and speeds of sound, uijk data of ternary {1-butyl-2,3- dimethylimidazolium tetrafluoroborate (i) + 1-butyl-3-methylimidazolium tetrafluoroborate or 1-ethyl- 3-methylimidazolium tetrafluoroborate (j) + cyclopentanone or cyclohexanone (k)} mixtures at temperatures 293.15 K to 308.15 K using a digital densimeter and speed of sound analyser. The observed qijk and uijk data have been employed to determine excess molar volumes, VE ijk and excess isentropic compressiblities, ojES Pijk respectively of the studied mixtures. The topology of the constituent molecules (Graph theory) of the binary ionic liquid mixtures has recently been utilized (Gupta et al., 2016) to predict their VE, jES , HE and Cp E data. In the present studies, the topology of the components of the ternary mixtures (comprise of two ionic liquids and one organic solvent) has been employed (Graph theory) to obtain expressions for VE ijk and ojES Pijk data that describe well the measured VE ijk and ojES Pijk values. The observed VE ijk and ojES Pijk values have also been tested in terms of Prigogine-Flory-Patterson (PFP) theory. It has been observed that VE ijk and ojES Pijk values predicted by Graph theory are comparable with the experimental values.
Compounds
# Formula Name
1 C9H17BF4N2 1-butyl-2,3-dimethylimidazolium tetrafluoroborate
2 C8H15BF4N2 1-butyl-3-methylimidazolium tetrafluoroborate
3 C6H11BF4N2 1-ethyl-3-methylimidazolium tetrafluoroborate
4 C5H8O cyclopentanone
5 C6H10O cyclohexanone
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
  • 4
  • 2
  • 1
  • Mass density, kg/m3 ; Liquid
  • Temperature, K; Liquid
  • Mole fraction - 1; Liquid
  • Mole fraction - 2; Liquid
  • Pressure, kPa; Liquid
  • Liquid
  • Vibrating tube method
  • 128
  • POMD
  • 4
  • 2
  • 1
  • Speed of sound, m/s ; Liquid
  • Temperature, K; Liquid
  • Mole fraction - 1; Liquid
  • Mole fraction - 2; Liquid
  • Pressure, kPa; Liquid
  • Frequency, MHz; Liquid
  • Liquid
  • Single path-length method
  • 128
  • POMD
  • 5
  • 2
  • 1
  • Mass density, kg/m3 ; Liquid
  • Temperature, K; Liquid
  • Mole fraction - 1; Liquid
  • Mole fraction - 2; Liquid
  • Pressure, kPa; Liquid
  • Liquid
  • Vibrating tube method
  • 128
  • POMD
  • 5
  • 2
  • 1
  • Speed of sound, m/s ; Liquid
  • Temperature, K; Liquid
  • Mole fraction - 1; Liquid
  • Mole fraction - 2; Liquid
  • Pressure, kPa; Liquid
  • Frequency, MHz; Liquid
  • Liquid
  • Single path-length method
  • 128
  • POMD
  • 4
  • 3
  • 1
  • Mass density, kg/m3 ; Liquid
  • Temperature, K; Liquid
  • Mole fraction - 1; Liquid
  • Mole fraction - 3; Liquid
  • Pressure, kPa; Liquid
  • Liquid
  • Vibrating tube method
  • 128
  • POMD
  • 4
  • 3
  • 1
  • Speed of sound, m/s ; Liquid
  • Temperature, K; Liquid
  • Mole fraction - 1; Liquid
  • Mole fraction - 3; Liquid
  • Pressure, kPa; Liquid
  • Frequency, MHz; Liquid
  • Liquid
  • Single path-length method
  • 128
  • POMD
  • 5
  • 3
  • 1
  • Mass density, kg/m3 ; Liquid
  • Temperature, K; Liquid
  • Mole fraction - 1; Liquid
  • Mole fraction - 3; Liquid
  • Pressure, kPa; Liquid
  • Liquid
  • Vibrating tube method
  • 128
  • POMD
  • 5
  • 3
  • 1
  • Speed of sound, m/s ; Liquid
  • Temperature, K; Liquid
  • Mole fraction - 1; Liquid
  • Mole fraction - 3; Liquid
  • Pressure, kPa; Liquid
  • Frequency, MHz; Liquid
  • Liquid
  • Single path-length method
  • 128