Thermodynamics Research Center / ThermoML | Fluid Phase Equilibria

Liquid-liquid equilibrium data for binary systems containing o-dichlorobenzene and nitrobenzene

Gao, X.[Xinjing], Yang, Z.[Zhen], Xia, S.[Shuqian], Ma, P.[Peisheng]
Fluid Phase Equilib. 2015, 385, 175-181
ABSTRACT
The liquid liquid equilibrium (LLE) data of four binary systems (o-dichlorobenzene(1) + 1,2-ethanediol (2)), (o-dichlorobenzene(1) + 1,2-propanediol(2)), (nitrobenzene(1) + 1,2-ethanediol(2)) and (nitrobenzene( 1) + 1,2-propanediol(2)) under atmospheric pressure and at temperatures 290 400 K were determined in this study. The results indicated the mutual solubility between all the binary systems increased with temperatures. The NRTL and UNIQUAC models were applied to correlate the liquid liquid equilibrium data. In addition, the data were correlated well by the UNIFAC (Do) group contribution method, in which 1,2-ethanediol was treated as a single DOH group (methodI) or two CH2OH groups (method II), and 1,2-propanediol was divided into groups ( CH3, CH2OH, CHOH). The new group interaction parameters for (ACCl DOH, ACNO2 DOH, ACCl CH2OH, ACNO2 CH2OH, ACH CH2OH) were obtained by the experimental LLE data regression. Moreover, all the new interaction parameters except the group ACNO2 DOH were proved reliable, among which the parameters for ACCl DOH were proved by estimating the binary system (chlorobenzene + 1,2-ethanediol) LLE data from literature and the parameters for (ACCl CH2OH, ACNO2 CH2OH, ACH CH2OH) were proved by estimating the LLE data of the (o-dichlorobenzene(1) + 1,2-ethanediol(2)) and (nitrobenzene(1) + 1,2-ethanediol(2)) binary systems in this work.
Compounds
# Formula Name
1 C2H6O2 1,2-ethanediol
2 C3H8O2 1,2-propanediol
3 C6H4Cl2 1,2-dichlorobenzene
4 C6H5NO2 nitrobenzene
5 C7H8 toluene
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
  • 5
  • Mole fraction - 5 ; Liquid mixture 1
  • Temperature, K; Liquid mixture 1
  • Pressure, kPa; Liquid mixture 1
  • Liquid mixture 1
  • Liquid mixture 2
  • Chromatography
  • 13
  • POMD
  • 1
  • 5
  • Mole fraction - 5 ; Liquid mixture 2
  • Temperature, K; Liquid mixture 1
  • Pressure, kPa; Liquid mixture 1
  • Liquid mixture 2
  • Liquid mixture 1
  • Chromatography
  • 13
  • POMD
  • 3
  • 1
  • Mole fraction - 3 ; Liquid mixture 1
  • Temperature, K; Liquid mixture 1
  • Pressure, kPa; Liquid mixture 1
  • Liquid mixture 1
  • Liquid mixture 2
  • Chromatography
  • 10
  • POMD
  • 3
  • 1
  • Mole fraction - 3 ; Liquid mixture 2
  • Temperature, K; Liquid mixture 1
  • Pressure, kPa; Liquid mixture 1
  • Liquid mixture 2
  • Liquid mixture 1
  • Chromatography
  • 10
  • POMD
  • 2
  • 3
  • Mole fraction - 3 ; Liquid mixture 1
  • Temperature, K; Liquid mixture 1
  • Pressure, kPa; Liquid mixture 1
  • Liquid mixture 1
  • Liquid mixture 2
  • Chromatography
  • 6
  • POMD
  • 2
  • 3
  • Mole fraction - 3 ; Liquid mixture 2
  • Temperature, K; Liquid mixture 1
  • Pressure, kPa; Liquid mixture 1
  • Liquid mixture 2
  • Liquid mixture 1
  • Chromatography
  • 6
  • POMD
  • 2
  • 4
  • Mole fraction - 2 ; Liquid mixture 1
  • Temperature, K; Liquid mixture 1
  • Pressure, kPa; Liquid mixture 1
  • Liquid mixture 1
  • Liquid mixture 2
  • Chromatography
  • 9
  • POMD
  • 2
  • 4
  • Mole fraction - 2 ; Liquid mixture 2
  • Temperature, K; Liquid mixture 1
  • Pressure, kPa; Liquid mixture 1
  • Liquid mixture 2
  • Liquid mixture 1
  • Chromatography
  • 9
  • POMD
  • 4
  • 1
  • Mole fraction - 4 ; Liquid mixture 1
  • Temperature, K; Liquid mixture 1
  • Pressure, kPa; Liquid mixture 1
  • Liquid mixture 1
  • Liquid mixture 2
  • Chromatography
  • 9
  • POMD
  • 4
  • 1
  • Mole fraction - 4 ; Liquid mixture 2
  • Temperature, K; Liquid mixture 1
  • Pressure, kPa; Liquid mixture 1
  • Liquid mixture 2
  • Liquid mixture 1
  • Chromatography
  • 9