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

Experimental Measurements and Modeling Study of Liquid-Liquid Equilibrium [(Water + Methyl Oleate + Model Molecules of Tar Issued from the Biomass Gasification Process (Benzene, Toluene, Phenol, Thiophene, and Pyridine)]

Bassil, Georgio, Saab, Joseph, Mokbel, Ilham, Negadi, Latifa, Jose, Jacques, Goutaudier, Christelle
J. Chem. Eng. Data 2019, 64, 2, 497-506
ABSTRACT
Biomass is known as a potential renewable energy source which can be used in the gasification process in order to produce biomethane gas. One of the major challenges encountered is the elimination of the high level of tar found in the syngas issued from the gasification process. The main purpose of this work is to conduct experimental measurements of liquid-liquid equilibria that will be used for tar removal from the biomass gasification process which is the important step before the distribution and the industrialization of the biomethane gas. In the present work, we propose an experimental and modelling study of liquid-liquid equilibrium of ternary systems of water + solvent (methyl oleate) + model molecules of tar (benzene, toluene, phenol, thiophene and pyridine) at 303.2 K, 323.2 K and 343.2 K. The experimental results were correlated using the nonrandom two-liquid (NRTL) and UNIQUAC models and are used to feed the industrial needs for thermodynamic modeling.
Compounds
# Formula Name
1 H2O water
2 C19H36O2 methyl cis-9-octadecenoate
3 C6H6 benzene
4 C7H8 toluene
5 C6H6O phenol
6 C4H4S thiophene
7 C5H5N pyridine
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
  • 2
  • Mole fraction - 1 ; Liquid mixture 1
  • Temperature, K; Liquid mixture 1
  • Pressure, kPa; Liquid mixture 1
  • Liquid mixture 1
  • Liquid mixture 2
  • Chromatography
  • 3
  • POMD
  • 1
  • 2
  • Mole fraction - 2 ; Liquid mixture 2
  • Temperature, K; Liquid mixture 2
  • Pressure, kPa; Liquid mixture 2
  • Liquid mixture 2
  • Liquid mixture 1
  • Chromatography
  • 3
  • POMD
  • 2
  • 3
  • 1
  • Mole fraction - 2 ; Liquid mixture 1
  • Mole fraction - 1 ; Liquid mixture 2
  • Mole fraction - 3 ; Liquid mixture 2
  • Temperature, K; Liquid mixture 2
  • Mole fraction - 3; Liquid mixture 1
  • Pressure, kPa; Liquid mixture 2
  • Liquid mixture 1
  • Liquid mixture 2
  • Chromatography
  • Chromatography
  • Chromatography
  • 9
  • POMD
  • 2
  • 4
  • 1
  • Mole fraction - 1 ; Liquid mixture 2
  • Mole fraction - 2 ; Liquid mixture 1
  • Mole fraction - 4 ; Liquid mixture 1
  • Temperature, K; Liquid mixture 1
  • Mole fraction - 4; Liquid mixture 2
  • Pressure, kPa; Liquid mixture 2
  • Liquid mixture 2
  • Liquid mixture 1
  • Chromatography
  • Chromatography
  • Chromatography
  • 9
  • POMD
  • 2
  • 5
  • 1
  • Mole fraction - 1 ; Liquid mixture 2
  • Mole fraction - 2 ; Liquid mixture 1
  • Mole fraction - 5 ; Liquid mixture 1
  • Temperature, K; Liquid mixture 1
  • Mole fraction - 5; Liquid mixture 2
  • Pressure, kPa; Liquid mixture 2
  • Liquid mixture 2
  • Liquid mixture 1
  • Chromatography
  • Chromatography
  • Chromatography
  • 9
  • POMD
  • 2
  • 6
  • 1
  • Mole fraction - 1 ; Liquid mixture 2
  • Mole fraction - 2 ; Liquid mixture 1
  • Mole fraction - 6 ; Liquid mixture 1
  • Temperature, K; Liquid mixture 1
  • Mole fraction - 6; Liquid mixture 2
  • Pressure, kPa; Liquid mixture 2
  • Liquid mixture 2
  • Liquid mixture 1
  • Chromatography
  • Chromatography
  • Chromatography
  • 9
  • POMD
  • 2
  • 7
  • 1
  • Mole fraction - 1 ; Liquid mixture 2
  • Mole fraction - 2 ; Liquid mixture 1
  • Mole fraction - 7 ; Liquid mixture 1
  • Temperature, K; Liquid mixture 1
  • Mole fraction - 7; Liquid mixture 2
  • Pressure, kPa; Liquid mixture 2
  • Liquid mixture 2
  • Liquid mixture 1
  • Chromatography
  • Chromatography
  • Chromatography
  • 9