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

Structural Dependence of Protic Ionic Liquids on Surface, Optical, and Transport Properties

Chhotaray, P. K.[Pratap K.], Gardas, R. L.[Ramesh L.]
J. Chem. Eng. Data 2015, 60, 6, 1868-1877
ABSTRACT
We report a systematic study to understand the structural dependence of protic ionic liquids, having ammonium or hydroxylammonium as cation and carboxylate as anion, on surface, optical, and transport properties. Experimental measurements of surface tension, refractive index, and electrical conductivity were investigated in the temperature range from (293.15 to 333.15) K at atmospheric pressure to understand the effect of the hydroxyl group on the cationic part and alky chain length and inclusion of highly electronegative fluorine atoms on the anionic part of studied protic ionic liquids. Further, surface entropy, surface energy, critical temperature, parachor, molar refraction, electronic polarizability, thermo-optic coefficient, and free volume were estimated from experimental values. Experimental electrical conductivity data were correlated using the Vogel Tammann Fulcher equation. The ionicity was assessed on the basis of the fractional Walden rule, and it was found that the studied protic ionic liquids fall below the ideal line. Upon hydroxyl group functionalization on the cationic chain length, the surface tension and refractive index of ionic liquids increase significantly, whereas the electrical conductivity decreases over the nonfunctionalized ionic liquid counterpart. Moreover, experimental and calculated results were explained to understand the effect of temperature and moiety of ionic liquid on studied thermophysical properties.
Compounds
# Formula Name
1 C4H11NO2 propylammonium formate
2 C5H13NO2 propylammonium acetate
3 C4H11NO3 3-hydroxypropylammonium formate
4 C5H13NO3 3-hydroxypropylammonium acetate
5 C5H10F3NO3 3-hydroxypropylammonium trifluoroacetate
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
  • Surface tension liquid-gas, N/m ; Liquid
  • Temperature, K; Liquid
  • Liquid
  • Air at 1 atmosphere
  • Ring tensiometer
  • 9
  • POMD
  • 1
  • Refractive index (Na D-line) ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Liquid
  • Standard Abbe refractometry
  • 9
  • POMD
  • 1
  • Electrical conductivity, S/m ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Liquid
  • Alternating current cell with electrodes
  • 9
  • POMD
  • 2
  • Surface tension liquid-gas, N/m ; Liquid
  • Temperature, K; Liquid
  • Liquid
  • Air at 1 atmosphere
  • Ring tensiometer
  • 9
  • POMD
  • 2
  • Refractive index (Na D-line) ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Liquid
  • Standard Abbe refractometry
  • 9
  • POMD
  • 2
  • Electrical conductivity, S/m ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Liquid
  • Alternating current cell with electrodes
  • 9
  • POMD
  • 3
  • Surface tension liquid-gas, N/m ; Liquid
  • Temperature, K; Liquid
  • Liquid
  • Air at 1 atmosphere
  • Ring tensiometer
  • 9
  • POMD
  • 3
  • Refractive index (Na D-line) ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Liquid
  • Standard Abbe refractometry
  • 9
  • POMD
  • 3
  • Electrical conductivity, S/m ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Liquid
  • Alternating current cell with electrodes
  • 9
  • POMD
  • 4
  • Surface tension liquid-gas, N/m ; Liquid
  • Temperature, K; Liquid
  • Liquid
  • Air at 1 atmosphere
  • Ring tensiometer
  • 9
  • POMD
  • 4
  • Refractive index (Na D-line) ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Liquid
  • Standard Abbe refractometry
  • 9
  • POMD
  • 4
  • Electrical conductivity, S/m ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Liquid
  • Alternating current cell with electrodes
  • 9
  • POMD
  • 5
  • Surface tension liquid-gas, N/m ; Liquid
  • Temperature, K; Liquid
  • Liquid
  • Air at 1 atmosphere
  • Ring tensiometer
  • 9
  • POMD
  • 5
  • Refractive index (Na D-line) ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Liquid
  • Standard Abbe refractometry
  • 9
  • POMD
  • 5
  • Electrical conductivity, S/m ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Liquid
  • Alternating current cell with electrodes
  • 9