Thermodynamics Research Center / ThermoML | Fluid Phase Equilibria

Effect of anion chain length on physicochemical properties of N,N-dimethylethanolammonium based protic ionic liquids

Sharma, G.[Gyanendra], Gardas, R. L.[Ramesh L.], Coronas, A.[Alberto], Venkatarathnam, G.
Fluid Phase Equilib. 2016, 415, 1-7
ABSTRACT
N,N-dimethylethanolammonium (DMEA) based ionic liquids with carboxylate anions are very important in organic synthesis, gas absorption, biological and pharmaceutical applications. The fundamental physiochemical properties will give a platform to better understanding of their nature for scientific community. Here in this work, five DMEA based protic ionic liquids (PILs) with carboxylates were synthesized and their physicochemical properties such as density (r) and speed of sound (u) were measured as a function of temperature from (293.15 - 343.15) K at 0.1 MPa pressure. Several derived thermophysical properties such as molecular volume (Vm), standard entropy (S ), isothermal expansion coefficient (a) and isentropic compressibility have been calculated using experimental data. The effects of carboxylate anion chain length and temperature on physicochemical properties have been discussed. The crystal potential energy (UPOT) of ionic liquid compared with MX type of inorganic salt and discussed for ion interaction in PILs.
Compounds
# Formula Name
1 C6H15NO3 2-hydroxy-N,N-dimethylethan-1-aminium acetate
2 C7H17NO3 2-hydroxy-N,N-dimethylethan-1-aminium propionate
3 C8H19NO3 2-hydroxy-N,N-dimethylethan-1-aminium butyrate
4 C9H21NO3 2-hydroxy-N,N-dimethylethan-1-aminium pentanoate
5 C10H23NO3 2-hydroxy-N,N-dimethylethan-1-aminium hexanoate
6 H2O water
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
  • Mass density, kg/m3 ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Liquid
  • Vibrating tube method
  • 11
  • POMD
  • 1
  • Speed of sound, m/s ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Liquid
  • Sing-around technique in a fixed-path interferometer
  • 11
  • POMD
  • 2
  • Mass density, kg/m3 ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Liquid
  • Vibrating tube method
  • 11
  • POMD
  • 2
  • Speed of sound, m/s ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Liquid
  • Sing-around technique in a fixed-path interferometer
  • 11
  • POMD
  • 3
  • Mass density, kg/m3 ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Liquid
  • Vibrating tube method
  • 11
  • POMD
  • 3
  • Speed of sound, m/s ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Liquid
  • Sing-around technique in a fixed-path interferometer
  • 11
  • POMD
  • 4
  • Mass density, kg/m3 ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Liquid
  • Vibrating tube method
  • 11
  • POMD
  • 4
  • Speed of sound, m/s ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Liquid
  • Sing-around technique in a fixed-path interferometer
  • 11
  • POMD
  • 5
  • Mass density, kg/m3 ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Liquid
  • Vibrating tube method
  • 11
  • POMD
  • 5
  • Speed of sound, m/s ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Liquid
  • Sing-around technique in a fixed-path interferometer
  • 11
  • POMD
  • 6
  • 3
  • Mass density, kg/m3 ; Liquid
  • Mass fraction - 6; Liquid
  • Pressure, kPa; Liquid
  • Temperature, K; Liquid
  • Liquid
  • Vibrating tube method
  • 4
  • POMD
  • 6
  • 3
  • Speed of sound, m/s ; Liquid
  • Mass fraction - 6; Liquid
  • Pressure, kPa; Liquid
  • Temperature, K; Liquid
  • Frequency, MHz; Liquid
  • Liquid
  • Sing-around technique in a fixed-path interferometer
  • 4