ChemSpider 2D Image | 2-Ammonioethyl (2R)-2-[(9Z)-9-hexadecenoyloxy]-3-(palmitoyloxy)propyl phosphate | C37H72NO8P

2-Ammonioethyl (2R)-2-[(9Z)-9-hexadecenoyloxy]-3-(palmitoyloxy)propyl phosphate

  • Molecular FormulaC37H72NO8P
  • Average mass689.943 Da
  • Monoisotopic mass689.499573 Da
  • ChemSpider ID24768424

  • Double-bond stereo - Double-bond stereo

    defined stereocentres - 1 of 1 defined stereocentres

More details:

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

2-Ammonioethyl (2R)-2-[(9Z)-9-hexadecenoyloxy]-3-(palmitoyloxy)propyl phosphate [ACD/IUPAC Name]
2-Ammonioethyl-(2R)-2-[(9Z)-9-hexadecenoyloxy]-3-(palmitoyloxy)propylphosphat [German] [ACD/IUPAC Name]
9-Hexadecenoic acid, (1R)-2-[[(2-aminoethoxy)hydroxyphosphinyl]oxy]-1-[[(1-oxohexadecyl)oxy]methyl]ethyl ester, (9Z)- [ACD/Index Name]
Phosphate de 2-ammonioéthyle et de (2R)-2-[(9Z)-9-hexadecenoyloxy]-3-(palmitoyloxy)propyle [French] [ACD/IUPAC Name]
(2-aminoethoxy)[(2R)-2-(hexadec-9-enoyloxy)-3-(hexadecanoyloxy)propoxy]phosphinic acid
(2-AMINOETHOXY)[(2R)-2-[(9Z)-HEXADEC-9-ENOYLOXY]-3-(HEXADECANOYLOXY)PROPOXY]PHOSPHINIC ACID
(3-Phosphatidyl)ethanolamine
(3-Phosphatidyl)-ethanolamine
1,2-DIACYL-SN-GLYCERO-3-PHOSPHOETHANOLAMINE
1-Acyl-2-acyl-sn-glycero-3-phosphoethanolamine
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

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

Density:
Boiling Point: 723.1±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±5.1 mmHg at 25°C
Enthalpy of Vaporization: 115.0±6.0 kJ/mol
Flash Point: 391.1±35.7 °C
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 9
#H bond donors: 3
#Freely Rotating Bonds: 38
#Rule of 5 Violations: 2
ACD/LogP: 13.19
ACD/LogD (pH 5.5): 8.98
ACD/BCF (pH 5.5): 979428.00
ACD/KOC (pH 5.5): 131521.61
ACD/LogD (pH 7.4): 8.88
ACD/BCF (pH 7.4): 789060.81
ACD/KOC (pH 7.4): 105958.31
Polar Surface Area: 149 Å2
Polarizability:
Surface Tension:
Molar Volume:

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