ChemSpider 2D Image | 1,2-distearoylphosphatidylethanolaminium | C41H83NO8P

1,2-distearoylphosphatidylethanolaminium

  • Molecular FormulaC41H83NO8P
  • Average mass749.073 Da
  • Monoisotopic mass748.585083 Da
  • ChemSpider ID24887435

  • Charge - Charge

More details:

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

1,2-distearoylphosphatidylethanolaminium
4-Hydroxy-10-oxo-7-(stearoyloxy)-3,5,9-trioxa-4-phosphaheptacosan-1-aminium 4-oxide [ACD/IUPAC Name]
4-Hydroxy-10-oxo-7-(stearoyloxy)-3,5,9-trioxa-4-phosphaheptacosan-1-aminium-4-oxid [German] [ACD/IUPAC Name]
4-Oxyde de 4-hydroxy-10-oxo-7-(stearoyloxy)-3,5,9-trioxa-4-phosphaheptacosan-1-aminium [French] [ACD/IUPAC Name]
Octadecanoic acid, 1-[[[(2-aminoethoxy)hydroxyphosphinyl]oxy]methyl]-1,2-ethanediyl ester, conjugate acid [ACD/Index Name]
4-hydroxy-7-(octadecanoyloxy)-10-oxo-3,5,9-trioxa-4-phosphaheptacosan-1-aminium 4-oxide

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

CHEBI:47769 [DBID]
  • Miscellaneous

    • Chemical Class:

      An ammonium ion that is the conjugate acid of 1,2-distearoylphosphatidylethanolamine, arising from protonation of the amino group. ChEBI CHEBI:47769

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

Density:
Boiling Point: 760.2±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±5.5 mmHg at 25°C
Enthalpy of Vaporization: 120.5±6.0 kJ/mol
Flash Point: 413.5±35.7 °C
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 9
#H bond donors: 3
#Freely Rotating Bonds: 43
#Rule of 5 Violations: 2
ACD/LogP: 15.83
ACD/LogD (pH 5.5): 11.34
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 2552900.75
ACD/LogD (pH 7.4): 11.25
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 2056706.63
Polar Surface Area: 146 Å2
Polarizability:
Surface Tension:
Molar Volume:

Click to predict properties on the Chemicalize site


Advertisement