ChemSpider 2D Image | 2-Oxo-3-(stearoyloxy)propyl phosphate | C21H39O7P

2-Oxo-3-(stearoyloxy)propyl phosphate

  • Molecular FormulaC21H39O7P
  • Average mass434.505 Da
  • Monoisotopic mass434.244446 Da
  • ChemSpider ID34448709

  • Charge - Charge

More details:

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

2-Oxo-3-(stearoyloxy)propyl phosphate [ACD/IUPAC Name]
2-Oxo-3-(stearoyloxy)propylphosphat [German] [ACD/IUPAC Name]
Octadecanoic acid, 2-oxo-3-(phosphonooxy)propyl ester, ion(2-) [ACD/Index Name]
Phosphate de 2-oxo-3-(stearoyloxy)propyle [French] [ACD/IUPAC Name]
1-octadecanoylglycerone 3-phosphate
1-octadecanoylglycerone 3-phosphate(2-)
1-stearoylglycerone 3-phosphate
1-stearoylglycerone 3-phosphate(2-)
2-oxo-3-(phosphonooxy)propyl octadecanoate
3-(octadecanoyloxy)-2-oxopropyl phosphate
More...
  • Miscellaneous

    • Chemical Class:

      A 1-acylglycerone 3-phosphate(2-) obtained by deprotonation of the phospho groups of 1-stearoylglycerone 3-phosphate; major species at pH 7.3. ChEBI CHEBI:83203

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

Density:
Boiling Point: 555.3±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.2 mmHg at 25°C
Enthalpy of Vaporization: 91.5±6.0 kJ/mol
Flash Point: 289.6±32.9 °C
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 7
#H bond donors: 2
#Freely Rotating Bonds: 22
#Rule of 5 Violations: 1
ACD/LogP: 7.70
ACD/LogD (pH 5.5): 3.04
ACD/BCF (pH 5.5): 18.02
ACD/KOC (pH 5.5): 29.05
ACD/LogD (pH 7.4): 2.13
ACD/BCF (pH 7.4): 2.22
ACD/KOC (pH 7.4): 3.58
Polar Surface Area: 126 Å2
Polarizability:
Surface Tension:
Molar Volume:

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