ChemSpider 2D Image | 2,3-Bis{[(1E)-1-hydroxy-1-octen-1-yl]oxy}propyl trihydrogen diphosphate | C19H38O11P2

2,3-Bis{[(1E)-1-hydroxy-1-octen-1-yl]oxy}propyl trihydrogen diphosphate

  • Molecular FormulaC19H38O11P2
  • Average mass504.446 Da
  • Monoisotopic mass504.188934 Da
  • ChemSpider ID95702714

More details:

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

2,3-Bis{[(1E)-1-hydroxy-1-octen-1-yl]oxy}propyl trihydrogen diphosphate [ACD/IUPAC Name]
2,3-Bis{[(1E)-1-hydroxy-1-octen-1-yl]oxy}propyltrihydrogendiphosphat [German] [ACD/IUPAC Name]
Diphosphoric acid, mono[2,3-bis[[(1E)-1-hydroxy-1-octen-1-yl]oxy]propyl] ester [ACD/Index Name]
Trihydrogénodiphosphate de 2,3-bis{[(1E)-1-hydroxy-1-octén-1-yl]oxy}propyle [French] [ACD/IUPAC Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 675.5±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±4.5 mmHg at 25°C
Enthalpy of Vaporization: 108.1±6.0 kJ/mol
Flash Point: 362.3±34.3 °C
Index of Refraction: 1.517
Molar Refractivity: 118.2±0.3 cm3
#H bond acceptors: 11
#H bond donors: 5
#Freely Rotating Bonds: 20
#Rule of 5 Violations: 3
ACD/LogP: 4.79
ACD/LogD (pH 5.5): -2.04
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -2.74
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 192 Å2
Polarizability: 46.9±0.5 10-24cm3
Surface Tension: 54.0±3.0 dyne/cm
Molar Volume: 390.6±3.0 cm3

Click to predict properties on the Chemicalize site


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