ChemSpider 2D Image | 1-palmitoyl-2-oleoyl-sn-glycero-3-phosphoethanolamine | C39H76NO8P

1-palmitoyl-2-oleoyl-sn-glycero-3-phosphoethanolamine

  • Molecular FormulaC39H76NO8P
  • Average mass717.996 Da
  • Monoisotopic mass717.530884 Da
  • ChemSpider ID4446615

  • 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

(19R)-25-Amino-22-hydroxy-22-oxido-16-oxo-17,21,23-trioxa-22λ5-phosphapentacosan-19-yl (9Z)-octadec-9-enoate
1-Hexadecanoyl-2-(9Z-octadecenoyl)-sn-glycero-3-phosphoethanolamine
1-hexadecanoyl-2-(9Z-octadecenoyl)-sn-glycero-3-phosphoethanolamine zwitterion
1-palmitoyl-2-oleoyl-sn-glycero-3-phosphoethanolamine
247-894-0 [EINECS]
26662-94-2 [RN]
2-Ammonioethyl (2R)-2-[(9Z)-9-octadecenoyloxy]-3-(palmitoyloxy)propyl phosphate [ACD/IUPAC Name]
2-Ammonioethyl-(2R)-2-[(9Z)-9-octadecenoyloxy]-3-(palmitoyloxy)propylphosphat [German] [ACD/IUPAC Name]
9-Octadecenoic 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-octadecenoyloxy]-3-(palmitoyloxy)propyle [French] [ACD/IUPAC Name]
More...

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

VM33LRU3A6 [DBID]
110637 [DBID]
EPA Pesticide Chemical Code 079011 [DBID]
LMGP02010009 [DBID]
UNII:VM33LRU3A6 [DBID]
UNII-VM33LRU3A6 [DBID]

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

Density:
Boiling Point: 741.6±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±5.3 mmHg at 25°C
Enthalpy of Vaporization: 117.7±6.0 kJ/mol
Flash Point: 402.3±35.7 °C
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 9
#H bond donors: 3
#Freely Rotating Bonds: 40
#Rule of 5 Violations: 2
ACD/LogP: 14.25
ACD/LogD (pH 5.5): 9.92
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 429571.69
ACD/LogD (pH 7.4): 9.83
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 346077.69
Polar Surface Area: 149 Å2
Polarizability:
Surface Tension:
Molar Volume:

Click to predict properties on the Chemicalize site


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