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

Separation of Furfural from Ternary Mixtures

Fele, L.[Ljudmila], Grilc, V.[Viktor]
J. Chem. Eng. Data 2003, 48, 3, 564-570
ABSTRACT
Thermodynamic phase diagrams were investigated that play a very important role in designing the separation of furfural from the ternary mixtures furfural + 5-methylfurfural + water and furfural + acetic acid + water. The saturation vapor pressure of 5-methylfurfural in the temperature range from (359.95 to 450.19) K is reported, as well as VLE data for the two binary systems furfural + 5-methylfurfural and furfural + acetic acid at two pressures and LLE data for furfural + 5-methylfurfural + water at room temperature. The activity coefficients at infinite dilution were determined for water in 5-methylfurfural at a few temperatures by using an ebulliometric technique. Binary interaction parameters of UNIQUAC and NRTL local composition models were evaluated in order to simulate the separation of furfural from both ternary mixtures by means of a rectification process. Binary azeotropic points were estimated for the 5-methylfurfural + water system by using both models as well as residue curves of both ternary systems.
Compounds
# Formula Name
1 C5H4O2 2-furaldehyde
2 C6H6O2 5-methylfurfural
3 C2H4O2 acetic acid
4 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
  • Vapor or sublimation pressure, kPa ; Liquid
  • Temperature, K; Liquid
  • Liquid
  • Gas
  • EBULLIO:UFactor:16
  • 9
  • POMD
  • 2
  • Vapor or sublimation pressure, kPa ; Liquid
  • Temperature, K; Liquid
  • Liquid
  • Gas
  • EBULLIO:UFactor:16
  • 12
  • POMD
  • 3
  • Vapor or sublimation pressure, kPa ; Liquid
  • Temperature, K; Liquid
  • Liquid
  • Gas
  • EBULLIO:UFactor:16
  • 2
  • POMD
  • 1
  • 2
  • Boiling temperature at pressure P, K ; Liquid
  • Mole fraction - 1; Liquid
  • Pressure, kPa; Liquid
  • Liquid
  • Gas
  • EBULLIO:UFactor:4
  • 14
  • POMD
  • 1
  • 2
  • Boiling temperature at pressure P, K ; Liquid
  • Mole fraction - 1; Liquid
  • Pressure, kPa; Liquid
  • Liquid
  • Gas
  • EBULLIO:UFactor:4
  • 14
  • POMD
  • 1
  • 2
  • Mole fraction - 1 ; Gas
  • Mole fraction - 1; Liquid
  • Pressure, kPa; Liquid
  • Gas
  • Liquid
  • CHROM:UFactor:4
  • 12
  • POMD
  • 1
  • 2
  • Mole fraction - 1 ; Gas
  • Mole fraction - 1; Liquid
  • Pressure, kPa; Liquid
  • Gas
  • Liquid
  • CHROM:UFactor:4
  • 12
  • POMD
  • 3
  • 1
  • Boiling temperature at pressure P, K ; Liquid
  • Mole fraction - 3; Liquid
  • Pressure, kPa; Liquid
  • Liquid
  • Gas
  • EBULLIO:UFactor:32
  • 15
  • POMD
  • 3
  • 1
  • Boiling temperature at pressure P, K ; Liquid
  • Mole fraction - 3; Liquid
  • Pressure, kPa; Liquid
  • Liquid
  • Gas
  • EBULLIO:UFactor:32
  • 15
  • POMD
  • 3
  • 1
  • Mole fraction - 3 ; Gas
  • Mole fraction - 3; Liquid
  • Pressure, kPa; Liquid
  • Gas
  • Liquid
  • CHROM:UFactor:4
  • 13
  • POMD
  • 3
  • 1
  • Mole fraction - 3 ; Gas
  • Mole fraction - 3; Liquid
  • Pressure, kPa; Liquid
  • Gas
  • Liquid
  • CHROM:UFactor:4
  • 13
  • POMD
  • 2
  • 4
  • Activity coefficient - 4 ; Liquid
  • Temperature, K; Liquid
  • Mole fraction - 4; Liquid
  • Liquid
  • Gas
  • OTHER
  • 3
  • POMD
  • 1
  • 2
  • 4
  • Mole fraction - 4 ; Liquid mixture 1
  • Mole fraction - 4 ; Liquid mixture 2
  • Mole fraction - 2 ; Liquid mixture 2
  • Mole fraction - 2; Liquid mixture 1
  • Temperature, K; Liquid mixture 1
  • Pressure, kPa; Liquid mixture 1
  • Liquid mixture 1
  • Liquid mixture 2
  • CHROM:UFactor:4
  • CHROM:UFactor:4
  • CHROM:UFactor:4
  • 7