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

Solubilities of Phosphonic Acid, P,P'-(1,4-Piperazinediyl)bis-,P,P,P',P'-tetraphenyl Ester in Selected Solvents

Du, C.-J.[Chao-Jun], Wang, L. -S.[Li-Sheng], Yu, G.-M.[Guo-Min], Qi, C.-M.[Chun-Mei]
J. Chem. Eng. Data 2013, 58, 10, 2768-2774
ABSTRACT
Phosphonic acid, P,P'-(1,4-piperazinediyl)bis-,P,P,P',P'-tetraphenyl ester (PAPBE), as a versatile flame retardant, was prepared by a literature method. The solubilities of PAPBE in selected solvents have been measured under a range of temperatures from 283.15 K to 343.15 K. The experimental data were correlated with the Buchowski Ksiazczak (?h), Scatchard Hildebrand, Wilson, nonrandom two liquid (NRTL), and universal quasichemical (UNIQUAC) equations. The calculated results showed good agreement with the experimental data. The differential values of enthalpy and entropy of dissolution at saturation were also calculated by the van t Hoff equation. Toluene and acetone are shown to be good candidates as reaction solvents that can be applied to optimize the reactive crystallization process.
Compounds
# Formula Name
1 C28H28N2O6P2 tetraphenyl piperazine-1,4-diylbis(phosphonate)
2 C3H6O acetone
3 C4H8O tetrahydrofuran
4 C4H8O2 ethyl acetate
5 CHCl3 trichloromethane
6 C2H6O ethanol
7 C6H6 benzene
8 C7H8 toluene
9 CH2Cl2 dichloromethane
10 CH4O methanol
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
  • Mole fraction - 1 ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Liquid
  • Crystal - 1
  • Gravimetric method
  • 7
  • POMD
  • 3
  • 1
  • Mole fraction - 1 ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Liquid
  • Crystal - 1
  • Gravimetric method
  • 9
  • POMD
  • 4
  • 1
  • Mole fraction - 1 ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Liquid
  • Crystal - 1
  • Gravimetric method
  • 11
  • POMD
  • 5
  • 1
  • Mole fraction - 1 ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Liquid
  • Crystal - 1
  • Gravimetric method
  • 7
  • POMD
  • 6
  • 1
  • Mole fraction - 1 ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Liquid
  • Crystal - 1
  • Gravimetric method
  • 11
  • POMD
  • 7
  • 1
  • Mole fraction - 1 ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Liquid
  • Crystal - 1
  • Gravimetric method
  • 11
  • POMD
  • 8
  • 1
  • Mole fraction - 1 ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Liquid
  • Crystal - 1
  • Gravimetric method
  • 11
  • POMD
  • 9
  • 1
  • Mole fraction - 1 ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Liquid
  • Crystal - 1
  • Gravimetric method
  • 6
  • POMD
  • 10
  • 1
  • Mole fraction - 1 ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Liquid
  • Crystal - 1
  • Gravimetric method
  • 7