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

Determination and Modeling of Solid-Liquid Equilibrium for Ternary Systems of Terephthaldialdehyde + 4-Hydroxybenzaldehyde + Ethyl Acetate/Acetone

Li, Wentian, Cao, Yong, Lin, Hu, Chen, Jiao, Li, Xinbao, Zhao, Hongkun
J. Chem. Eng. Data 2018, 63, 12, 4786-4794
ABSTRACT
The stable solid-liquid phase equilibrium for Page 2 of 35 ternary systems of terephthaldialdehyde + 4-hydroxybenzaldehyde + ethyl acetate and terephthaldialdehyde + 4-hydroxybenzaldehyde + acetone was determined using the isothermal saturation method at 293.15 K, 303.15 K and 313.15 K under ambient pressure of 101.2 kPa. In terms of the obtained mutual solubility data, the isothermal phase diagrams of the two systems were constructed. At a given temperature, there were two pure solids formed, pure 4-hydroxybenzaldehyde and pure terephthaldialdehyde, which were identified by Schreinemakers' wet residue method and XRD analysis. The crystallization zones of pure 4-hydroxybenzaldehyde and pure terephthaldialdehyde increased with rising temperature. The crystalline zone of terephthaldialdehyde was larger than that of 4-hydroxybenzaldehyde at the same temperature. The mutual solubility data of solid-liquid phase equilibrium was correlated with NRTL and Wilson models. The calculated solubility data with NRTL model agreed well with the determined values. The mutual solubility data and ternary phase diagrams for the two systems were of great significance for optimizing the purification procedure of 4-hydroxybenzaldehyde and terephthaldialdehyde.
Compounds
# Formula Name
1 C7H6O2 4-hydroxybenzaldehyde
2 C8H6O2 terephthalic aldehyde
3 C4H8O2 ethyl acetate
4 C3H6O acetone
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
  • 2
  • 1
  • 3
  • Mass fraction - 1 ; Liquid
  • Temperature, K; Liquid
  • Mass fraction - 2; Liquid
  • Pressure, kPa; Liquid
  • Liquid
  • Crystal - 1
  • Chromatography
  • 12
  • POMD
  • 2
  • 1
  • 3
  • Mass fraction - 1 ; Liquid
  • Temperature, K; Liquid
  • Mass fraction - 2; Liquid
  • Pressure, kPa; Liquid
  • Liquid
  • Crystal - 2
  • Chromatography
  • 18
  • POMD
  • 2
  • 1
  • 4
  • Mass fraction - 1 ; Liquid
  • Temperature, K; Liquid
  • Mass fraction - 2; Liquid
  • Pressure, kPa; Liquid
  • Liquid
  • Crystal - 1
  • Chromatography
  • 12
  • POMD
  • 2
  • 1
  • 4
  • Mass fraction - 1 ; Liquid
  • Temperature, K; Liquid
  • Mass fraction - 2; Liquid
  • Pressure, kPa; Liquid
  • Liquid
  • Crystal - 2
  • Chromatography
  • 20