ChemSpider 2D Image | 2-Hydroxy-3-{[(1E,9E)-1-hydroxy-1,9-octadecadien-1-yl]oxy}propyl dihydrogen phosphate | C21H41O7P

2-Hydroxy-3-{[(1E,9E)-1-hydroxy-1,9-octadecadien-1-yl]oxy}propyl dihydrogen phosphate

  • Molecular FormulaC21H41O7P
  • Average mass436.520 Da
  • Monoisotopic mass436.259003 Da
  • ChemSpider ID95795381

  • Double-bond stereo - Double-bond stereo

More details:

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

1,2-Propanediol, 3-[[(1E,9E)-1-hydroxy-1,9-octadecadien-1-yl]oxy]-, 1-(dihydrogen phosphate) [ACD/Index Name]
2-Hydroxy-3-{[(1E,9E)-1-hydroxy-1,9-octadecadien-1-yl]oxy}propyl dihydrogen phosphate [ACD/IUPAC Name]
2-Hydroxy-3-{[(1E,9E)-1-hydroxy-1,9-octadecadien-1-yl]oxy}propyldihydrogenphosphat [German] [ACD/IUPAC Name]
Dihydrogénophosphate de 2-hydroxy-3-{[(1E,9E)-1-hydroxy-1,9-octadécadién-1-yl]oxy}propyle [French] [ACD/IUPAC Name]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.1±0.1 g/cm3
Boiling Point: 615.6±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±4.0 mmHg at 25°C
Enthalpy of Vaporization: 104.7±6.0 kJ/mol
Flash Point: 326.1±34.3 °C
Index of Refraction: 1.506
Molar Refractivity: 115.8±0.3 cm3
#H bond acceptors: 7
#H bond donors: 4
#Freely Rotating Bonds: 20
#Rule of 5 Violations: 1
ACD/LogP: 6.48
ACD/LogD (pH 5.5): 1.00
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 2.51
ACD/LogD (pH 7.4): 0.06
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 126 Å2
Polarizability: 45.9±0.5 10-24cm3
Surface Tension: 45.9±3.0 dyne/cm
Molar Volume: 389.5±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement