Thermodynamics Research Center / ThermoML | Fluid Phase Equilibria

Solid-liquid phase equilibrium of glyphosate in selected solvents

Jia, D.[Dongmei], Wang, L. -S.[Li-Sheng], Li, C.[Changhai], Wang, X.[XinXin]
Fluid Phase Equilib. 2012, 327, 1-8
ABSTRACT
Solid-liquid equilibrium (SLE) data for the glyphosate in methanol, ethanol, n-propanol, 2-propanol, acetone, benzene and ethyl acetate, and aqueous sodium chloride solutions were measured with a temperature range from (283 to 352) K. The hypothetical enthalpy of fusion and melting temperature of glyphosate were estimated. The Wilson model, the nonrandom two-liquid (NRTL) model, the universal quasi-chemical (UNIQUAC) model, and the Scatchard-Hildebrand (SH) model were applied to correlate the solid-liquid equilibrium. It is shown that the Wilson model can give better results than NRTL and UNIQUAC model. The solubility parameter of glyphosate was obtained based on the SH model. In aqueous sodium chloride solutions, the solubility of glyphosate increases with the molality of sodium chloride increasing. The system of glyphosate + sodium chloride + water is found to exhibit a synergistic effect.
Compounds
# Formula Name
1 C3H8NO5P (phosphonomethyl)glycine
2 CH4O methanol
3 C2H6O ethanol
4 C3H8O propan-1-ol
5 C3H8O propan-2-ol
6 C3H6O acetone
7 C6H6 benzene
8 C4H8O2 ethyl acetate
9 H2O water
10 ClNa sodium 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
  • 1
  • Normal melting temperature, K ; Crystal
  • Crystal
  • Liquid
  • Air at 1 atmosphere
  • DTA
  • 1
  • POMD
  • 2
  • 1
  • Mole fraction - 1 ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Liquid
  • Crystal - 1
  • gravimetric method
  • 9
  • POMD
  • 3
  • 1
  • Mole fraction - 1 ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Liquid
  • Crystal - 1
  • gravimetric method
  • 12
  • POMD
  • 4
  • 1
  • Mole fraction - 1 ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Liquid
  • Crystal - 1
  • gravimetric method
  • 14
  • POMD
  • 5
  • 1
  • Mole fraction - 1 ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Liquid
  • Crystal - 1
  • gravimetric method
  • 9
  • POMD
  • 6
  • 1
  • Mole fraction - 1 ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Liquid
  • Crystal - 1
  • gravimetric method
  • 9
  • POMD
  • 7
  • 1
  • Mole fraction - 1 ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Liquid
  • Crystal - 1
  • gravimetric method
  • 12
  • POMD
  • 8
  • 1
  • Mole fraction - 1 ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Liquid
  • Crystal - 1
  • gravimetric method
  • 8
  • POMD
  • 1
  • 9
  • Mole fraction - 1 ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Liquid
  • Crystal - 1
  • gravimetric method
  • 8
  • POMD
  • 1
  • 10
  • 9
  • Mole fraction - 1 ; Liquid
  • Solvent: Molality, mol/kg - 10; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Liquid
  • Crystal - 1
  • gravimetric
  • 48