ChemSpider 2D Image | 1-stearoyl-2-oleoyl-sn-glycero-3-phosphoethanolamine zwitterion | C41H80NO8P

1-stearoyl-2-oleoyl-sn-glycero-3-phosphoethanolamine zwitterion

  • Molecular FormulaC41H80NO8P
  • Average mass746.050 Da
  • Monoisotopic mass745.562134 Da
  • ChemSpider ID7825692

  • 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

1-stearoyl-2-oleoyl-sn-glycero-3-phosphoethanolamine zwitterion
2-Ammonioethyl (2R)-2-[(9Z)-9-octadecenoyloxy]-3-(stearoyloxy)propyl phosphate [ACD/IUPAC Name]
2-Ammonioethyl-(2R)-2-[(9Z)-9-octadecenoyloxy]-3-(stearoyloxy)propylphosphat [German] [ACD/IUPAC Name]
9-Octadecenoic acid, (1R)-2-[[(2-aminoethoxy)hydroxyphosphinyl]oxy]-1-[[(1-oxooctadecyl)oxy]methyl]ethyl ester, (9Z)- [ACD/Index Name]
Phosphate de 2-ammonioéthyle et de (2R)-2-[(9Z)-9-octadecenoyloxy]-3-(stearoyloxy)propyle [French] [ACD/IUPAC Name]
(2-aminoethoxy)[(2R)-2-(octadec-9-enoyloxy)-3-(octadecanoyloxy)propoxy]phosphinic acid
(2-AMINOETHOXY)[(2R)-2-[(9Z)-OCTADEC-9-ENOYLOXY]-3-(OCTADECANOYLOXY)PROPOXY]PHOSPHINIC ACID
(3-Phosphatidyl)ethanolamine
(3-Phosphatidyl)-ethanolamine
1,2-DIACYL-SN-GLYCERO-3-PHOSPHOETHANOLAMINE
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

LMGP02010036 [DBID]

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

Density:
Boiling Point: 759.7±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±5.5 mmHg at 25°C
Enthalpy of Vaporization: 120.4±6.0 kJ/mol
Flash Point: 413.2±35.7 °C
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 9
#H bond donors: 3
#Freely Rotating Bonds: 42
#Rule of 5 Violations: 2
ACD/LogP: 15.31
ACD/LogD (pH 5.5): 10.73
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 1190876.38
ACD/LogD (pH 7.4): 10.64
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 959410.88
Polar Surface Area: 149 Å2
Polarizability:
Surface Tension:
Molar Volume:

Click to predict properties on the Chemicalize site


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