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

Effect of Salt Type and Alkyl Chain Length on the Binodal Curve of an Aqueous Two-Phase System Composed of Imidazolium Ionic Liquids

Wu, Xueyan, Liu, Yang, Zhao, Yongjie, Cheong, Kit-Leong
J. Chem. Eng. Data 2018, 63, 9, 3297-3304
ABSTRACT
The binodal data for aqueous two-phase system (ATPS) containing 1-alkyl-3-methylimidazolium tetrafluoroborate ([Cnmim]BF4) (n=2, 3, 4) or 1-alkyl-3-methylimidazolium chloride ([Cnmim]Cl]) (n=2, 4, 6, 8, 10, 12), and inorganic salts (K2HPO4, NaH2PO4, (NH4)2SO4, NaCl) or organic salts (sodium citrate, sodium tartrate, sodium acetate) was widely determined at the T= 298.15 K, respectively. The various binodal curves could be fitted and summarized as two kinds of empirical nonlinear equations with the lowest standard deviation (SD). The effects of salt type and cation alkyl chain length of the ionic liquid (IL) on ATPS binodal curves were further discussed. It was displayed that the salting-out ability of different salts was a major factor in these ATPSs formation. For [Cnmim]BF4-based ATPS, the salting-out ability of various salts decreased in the following order: (NH4)2SO4 > Na3C6H5O7 > Na2C4H4O6 > NaH2PO4 > NaC2H3O2 > NaCl. For [Cnmim]Cl aqueous solution, only K2HPO4 or (NH4)2SO4 could cause the phase separation and formed ATPS, and the salting-out ability of K2HPO4 was stronger than the effect of (NH4)2SO4. The phase separation abilities of the researched [Cnmim]BF4 in the corresponding ATPS increased with the increase of cation alkyl chain length, while [C8mim]Cl had the best phase separation ability of the researched [Cnmim]Cl-based ATPS.
Compounds
# Formula Name
1 C6H11BF4N2 1-ethyl-3-methylimidazolium tetrafluoroborate
2 C7H13BF4N2 1-propyl-3-methylimidazolium tetrafluoroborate
3 C8H15BF4N2 1-butyl-3-methylimidazolium tetrafluoroborate
4 C6H11ClN2 1-ethyl-3-methylimidazolium chloride
5 C8H15ClN2 1-butyl-3-methylimidazolium chloride
6 HK2O4P dipotassium hydrogen phosphate
7 H2NaO4P sodium dihydrogen phosphate
8 H8N2O4S ammonium sulfate
9 ClNa sodium chloride
10 C6H5Na3O7 trisodium citrate
11 C4H4Na2O6 disodium L-tartrate
12 C2H3NaO2 sodium ethanoate
13 H2O water
14 C10H19ClN2 1-hexyl-3-methylimidazolium chloride
15 C12H23ClN2 1-methyl-3-octylimidazolium chloride
16 C14H27ClN2 1-decyl-3-methylimidazolium chloride
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
  • 10
  • 1
  • 13
  • Mass fraction - 1 ; Liquid mixture 1
  • Mass fraction - 10; Liquid mixture 1
  • Pressure, kPa; Liquid mixture 1
  • Temperature, K; Liquid mixture 1
  • Liquid mixture 1
  • Liquid mixture 2
  • Titration method
  • 26
  • POMD
  • 10
  • 2
  • 13
  • Mass fraction - 2 ; Liquid mixture 1
  • Mass fraction - 10; Liquid mixture 1
  • Pressure, kPa; Liquid mixture 1
  • Temperature, K; Liquid mixture 1
  • Liquid mixture 1
  • Liquid mixture 2
  • Titration method
  • 56
  • POMD
  • 10
  • 3
  • 13
  • Mass fraction - 3 ; Liquid mixture 1
  • Mass fraction - 10; Liquid mixture 1
  • Pressure, kPa; Liquid mixture 1
  • Temperature, K; Liquid mixture 1
  • Liquid mixture 1
  • Liquid mixture 2
  • Titration method
  • 63
  • POMD
  • 11
  • 1
  • 13
  • Mass fraction - 1 ; Liquid mixture 1
  • Mass fraction - 11; Liquid mixture 1
  • Pressure, kPa; Liquid mixture 1
  • Temperature, K; Liquid mixture 1
  • Liquid mixture 1
  • Liquid mixture 2
  • Titration method
  • 35
  • POMD
  • 11
  • 2
  • 13
  • Mass fraction - 2 ; Liquid mixture 1
  • Mass fraction - 11; Liquid mixture 1
  • Pressure, kPa; Liquid mixture 1
  • Temperature, K; Liquid mixture 1
  • Liquid mixture 1
  • Liquid mixture 2
  • Titration method
  • 46
  • POMD
  • 11
  • 3
  • 13
  • Mass fraction - 3 ; Liquid mixture 1
  • Mass fraction - 11; Liquid mixture 1
  • Pressure, kPa; Liquid mixture 1
  • Temperature, K; Liquid mixture 1
  • Liquid mixture 1
  • Liquid mixture 2
  • Titration method
  • 58
  • POMD
  • 12
  • 1
  • 13
  • Mass fraction - 1 ; Liquid mixture 1
  • Mass fraction - 12; Liquid mixture 1
  • Pressure, kPa; Liquid mixture 1
  • Temperature, K; Liquid mixture 1
  • Liquid mixture 1
  • Liquid mixture 2
  • Titration method
  • 31
  • POMD
  • 12
  • 2
  • 13
  • Mass fraction - 2 ; Liquid mixture 1
  • Mass fraction - 12; Liquid mixture 1
  • Pressure, kPa; Liquid mixture 1
  • Temperature, K; Liquid mixture 1
  • Liquid mixture 1
  • Liquid mixture 2
  • Titration method
  • 34
  • POMD
  • 12
  • 3
  • 13
  • Mass fraction - 3 ; Liquid mixture 1
  • Mass fraction - 12; Liquid mixture 1
  • Pressure, kPa; Liquid mixture 1
  • Temperature, K; Liquid mixture 1
  • Liquid mixture 1
  • Liquid mixture 2
  • Titration method
  • 52
  • POMD
  • 7
  • 1
  • 13
  • Mass fraction - 1 ; Liquid mixture 1
  • Mass fraction - 7; Liquid mixture 1
  • Pressure, kPa; Liquid mixture 1
  • Temperature, K; Liquid mixture 1
  • Liquid mixture 1
  • Liquid mixture 2
  • Titration method
  • 46
  • POMD
  • 7
  • 2
  • 13
  • Mass fraction - 2 ; Liquid mixture 1
  • Mass fraction - 7; Liquid mixture 1
  • Pressure, kPa; Liquid mixture 1
  • Temperature, K; Liquid mixture 1
  • Liquid mixture 1
  • Liquid mixture 2
  • Titration method
  • 43
  • POMD
  • 7
  • 3
  • 13
  • Mass fraction - 3 ; Liquid mixture 1
  • Mass fraction - 7; Liquid mixture 1
  • Pressure, kPa; Liquid mixture 1
  • Temperature, K; Liquid mixture 1
  • Liquid mixture 1
  • Liquid mixture 2
  • Titration method
  • 47
  • POMD
  • 8
  • 1
  • 13
  • Mass fraction - 1 ; Liquid mixture 1
  • Mass fraction - 8; Liquid mixture 1
  • Pressure, kPa; Liquid mixture 1
  • Temperature, K; Liquid mixture 1
  • Liquid mixture 1
  • Liquid mixture 2
  • Titration method
  • 39
  • POMD
  • 8
  • 2
  • 13
  • Mass fraction - 2 ; Liquid mixture 1
  • Mass fraction - 8; Liquid mixture 1
  • Pressure, kPa; Liquid mixture 1
  • Temperature, K; Liquid mixture 1
  • Liquid mixture 1
  • Liquid mixture 2
  • Titration method
  • 49
  • POMD
  • 8
  • 3
  • 13
  • Mass fraction - 3 ; Liquid mixture 1
  • Mass fraction - 8; Liquid mixture 1
  • Pressure, kPa; Liquid mixture 1
  • Temperature, K; Liquid mixture 1
  • Liquid mixture 1
  • Liquid mixture 2
  • Titration method
  • 40
  • POMD
  • 9
  • 3
  • 13
  • Mass fraction - 3 ; Liquid mixture 1
  • Mass fraction - 9; Liquid mixture 1
  • Pressure, kPa; Liquid mixture 1
  • Temperature, K; Liquid mixture 1
  • Liquid mixture 1
  • Liquid mixture 2
  • Titration method
  • 35
  • POMD
  • 4
  • 6
  • 13
  • Mass fraction - 6 ; Liquid mixture 1
  • Mass fraction - 4; Liquid mixture 1
  • Pressure, kPa; Liquid mixture 1
  • Temperature, K; Liquid mixture 1
  • Liquid mixture 1
  • Liquid mixture 2
  • Titration method
  • 59
  • POMD
  • 5
  • 6
  • 13
  • Mass fraction - 6 ; Liquid mixture 1
  • Mass fraction - 5; Liquid mixture 1
  • Pressure, kPa; Liquid mixture 1
  • Temperature, K; Liquid mixture 1
  • Liquid mixture 1
  • Liquid mixture 2
  • Titration method
  • 68
  • POMD
  • 14
  • 6
  • 13
  • Mass fraction - 6 ; Liquid mixture 1
  • Mass fraction - 14; Liquid mixture 1
  • Pressure, kPa; Liquid mixture 1
  • Temperature, K; Liquid mixture 1
  • Liquid mixture 1
  • Liquid mixture 2
  • Titration method
  • 29
  • POMD
  • 15
  • 6
  • 13
  • Mass fraction - 6 ; Liquid mixture 1
  • Mass fraction - 15; Liquid mixture 1
  • Pressure, kPa; Liquid mixture 1
  • Temperature, K; Liquid mixture 1
  • Liquid mixture 1
  • Liquid mixture 2
  • Titration method
  • 25
  • POMD
  • 16
  • 6
  • 13
  • Mass fraction - 6 ; Liquid mixture 1
  • Mass fraction - 16; Liquid mixture 1
  • Pressure, kPa; Liquid mixture 1
  • Temperature, K; Liquid mixture 1
  • Liquid mixture 1
  • Liquid mixture 2
  • Titration method
  • 24