Thermodynamics Research Center / ThermoML | Journal of Chemical Thermodynamics

Determination and correlation of the solubility of four Bronsted-acidic ionic liquids based on benzothiazolium cations in six alcohols

Wang, L.[Litao], Wang, X.[Xiaomin], Zuo, T.[Tao], Sun, Q.[Qiaomei], Liu, P.[Pengcheng], Yao, S.[Shun], Song, H.[Hang]
J. Chem. Thermodyn. 2014, 72, 48-53
ABSTRACT
Solubilities of four acidic ionic liquids based on benzothiazolium cations in six alcohols (methanol, ethanol, 1-propanol, 2-propanol, 1-butanol and 2-methyl-1-propanol) from at temperatures from (253 to 384) K were determined using a static equilibrium method under atmospheric pressure. The modified Apelblat equation and kh equation were employed to correlate the experimental data with good agreement. The solubilities of ILs increase with increasing temperature. It is interesting to find that the solubility of some ILs in alcohols are with temperature-sensitive properties. The solubility is related with the polarity and molecular structures of the solvent, as well as the strength of hydrogen bonding between alcohols and anionic groups of ILs. The dissolution enthalpy and entropy of ILs were calculated by the van t Hoff equation. This study provides useful information for further research and application of the ionic liquids.
Compounds
# Formula Name
1 C7H6BF4NS benzothiazolium tetrafluoroborate
2 C14H13NO3S2 benzothiazolium p-toluenesulfonate
3 C8H9NO3S2 benzothiazolium methanesulfonate
4 C8H6F3NO3S2 benzothiazolium trifluoromethanesulfonate
5 CH4O methanol
6 C2H6O ethanol
7 C3H8O propan-1-ol
8 C3H8O propan-2-ol
9 C4H10O butan-1-ol
10 C4H10O 2-methyl-1-propanol
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
  • Normal melting temperature, K ; Crystal
  • Crystal
  • Liquid
  • Air at 1 atmosphere
  • VISOBS
  • 1
  • POMD
  • 2
  • Normal melting temperature, K ; Crystal
  • Crystal
  • Liquid
  • Air at 1 atmosphere
  • VISOBS
  • 1
  • POMD
  • 3
  • Normal melting temperature, K ; Crystal
  • Crystal
  • Liquid
  • Air at 1 atmosphere
  • VISOBS
  • 1
  • POMD
  • 4
  • Normal melting temperature, K ; Crystal
  • Crystal
  • Liquid
  • Air at 1 atmosphere
  • VISOBS
  • 1
  • POMD
  • 5
  • 1
  • Mole fraction - 1 ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Liquid
  • Crystal - 1
  • UV-Vis spectrophotometry
  • 10
  • POMD
  • 5
  • 2
  • Mole fraction - 2 ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Liquid
  • Crystal - 2
  • UV-Vis spectrophotometry
  • 10
  • POMD
  • 5
  • 3
  • Mole fraction - 3 ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Liquid
  • Crystal - 3
  • UV-Vis spectrophotometry
  • 10
  • POMD
  • 5
  • 4
  • Mole fraction - 4 ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Liquid
  • Crystal - 4
  • UV-Vis spectrophotometry
  • 10
  • POMD
  • 6
  • 1
  • Mole fraction - 1 ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Liquid
  • Crystal - 1
  • UV-Vis spectrophotometry
  • 12
  • POMD
  • 6
  • 2
  • Mole fraction - 2 ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Liquid
  • Crystal - 2
  • UV-Vis spectrophotometry
  • 12
  • POMD
  • 6
  • 3
  • Mole fraction - 3 ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Liquid
  • Crystal - 3
  • UV-Vis spectrophotometry
  • 12
  • POMD
  • 6
  • 4
  • Mole fraction - 4 ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Liquid
  • Crystal - 4
  • UV-Vis spectrophotometry
  • 12
  • POMD
  • 7
  • 1
  • Mole fraction - 1 ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Liquid
  • Crystal - 1
  • UV-Vis spectrophotometry
  • 14
  • POMD
  • 7
  • 2
  • Mole fraction - 2 ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Liquid
  • Crystal - 2
  • UV-Vis spectrophotometry
  • 14
  • POMD
  • 7
  • 3
  • Mole fraction - 3 ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Liquid
  • Crystal - 3
  • UV-Vis spectrophotometry
  • 14
  • POMD
  • 7
  • 4
  • Mole fraction - 4 ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Liquid
  • Crystal - 4
  • UV-Vis spectrophotometry
  • 14
  • POMD
  • 8
  • 1
  • Mole fraction - 1 ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Liquid
  • Crystal - 1
  • UV-Vis spectrophotometry
  • 13
  • POMD
  • 8
  • 2
  • Mole fraction - 2 ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Liquid
  • Crystal - 2
  • UV-Vis spectrophotometry
  • 13
  • POMD
  • 8
  • 3
  • Mole fraction - 3 ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Liquid
  • Crystal - 3
  • UV-Vis spectrophotometry
  • 13
  • POMD
  • 8
  • 4
  • Mole fraction - 4 ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Liquid
  • Crystal - 4
  • UV-Vis spectrophotometry
  • 13
  • POMD
  • 9
  • 1
  • Mole fraction - 1 ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Liquid
  • Crystal - 1
  • UV-Vis spectrophotometry
  • 16
  • POMD
  • 9
  • 2
  • Mole fraction - 2 ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Liquid
  • Crystal - 2
  • UV-Vis spectrophotometry
  • 16
  • POMD
  • 9
  • 3
  • Mole fraction - 3 ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Liquid
  • Crystal - 3
  • UV-Vis spectrophotometry
  • 15
  • POMD
  • 9
  • 3
  • Mole fraction - 3 ; Liquid mixture 1
  • Temperature, K; Liquid mixture 1
  • Pressure, kPa; Liquid mixture 1
  • Liquid mixture 1
  • Liquid mixture 2
  • UV-Vis spectrophotometry
  • 1
  • POMD
  • 9
  • 4
  • Mole fraction - 4 ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Liquid
  • Crystal - 4
  • UV-Vis spectrophotometry
  • 16
  • POMD
  • 10
  • 1
  • Mole fraction - 1 ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Liquid
  • Crystal - 1
  • UV-Vis spectrophotometry
  • 16
  • POMD
  • 10
  • 2
  • Mole fraction - 2 ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Liquid
  • Crystal - 2
  • UV-Vis spectrophotometry
  • 16
  • POMD
  • 10
  • 3
  • Mole fraction - 3 ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Liquid
  • Crystal - 3
  • UV-Vis spectrophotometry
  • 15
  • POMD
  • 10
  • 3
  • Mole fraction - 3 ; Liquid mixture 1
  • Temperature, K; Liquid mixture 1
  • Pressure, kPa; Liquid mixture 1
  • Liquid mixture 1
  • Liquid mixture 2
  • UV-Vis spectrophotometry
  • 1
  • POMD
  • 10
  • 4
  • Mole fraction - 4 ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Liquid
  • Crystal - 4
  • UV-Vis spectrophotometry
  • 16