ChemSpider 2D Image | 1-O-hexadecyl-2-oleoyl-sn-glycero-3-phosphocholine | C42H84NO7P

1-O-hexadecyl-2-oleoyl-sn-glycero-3-phosphocholine

  • Molecular FormulaC42H84NO7P
  • Average mass746.093 Da
  • Monoisotopic mass745.598511 Da
  • ChemSpider ID24822830

  • 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

(2R)-3-(Hexadecyloxy)-2-[(9Z)-9-octadecenoyloxy]propyl 2-(trimethylammonio)ethyl phosphate [ACD/IUPAC Name]
(2R)-3-(Hexadecyloxy)-2-[(9Z)-9-octadecenoyloxy]propyl-2-(trimethylammonio)ethylphosphat [German] [ACD/IUPAC Name]
1-hexadecyl-2-[(Z)-octadec-9-enoyl]-sn-glycero-3-phosphocholine
1-O-hexadecyl-2-oleoyl-sn-glycero-3-phosphocholine
Ethanaminium, 2-[[[(2R)-3-(hexadecyloxy)-2-[[(9Z)-1-oxo-9-octadecen-1-yl]oxy]propoxy]hydroxyphosphinyl]oxy]-N,N,N-trimethyl-, inner salt [ACD/Index Name]
Phosphate de (2R)-3-(hexadécyloxy)-2-[(9Z)-9-octadecenoyloxy]propyle et de 2-(triméthylammonio)éthyle [French] [ACD/IUPAC Name]
(2R)-3-(hexadecyloxy)-2-[(9Z)-octadec-9-enoyloxy]propyl 2-(trimethylammonio)ethyl phosphate
(2R)-3-(hexadecyloxy)-2-{[(9Z)-octadec-9-enoyl]oxy}propyl 2-(trimethylazaniumyl)ethyl phosphate
1-hexadecyl-2-(9Z-octadecenoyl)-sn-glycero-3-phosphocholine
1-hexadecyl-2-oleoyl-sn-glycero-3-phosphocholine
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

  • Miscellaneous

    • Chemical Class:

      A 2-acyl-1-alkyl-<ital>sn</ital>-glycero-3-phosphocholine in which the acyl and alkyl groups are specified as oleoyl and hexadecyl respectively. ChEBI CHEBI:75268, CHEBI:34112
      A 2-acyl-1-alkyl-sn-glycero-3-phosphocholine in which the acyl and alkyl groups are specified as oleoyl and hexadecyl respectively. ChEBI https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:34112
      A 2-acyl-1-alkyl-<ital>sn</ital>-glycero-3-phosphocholine betaine in which the alkyl and the acyl groups at positions 1 and 2 are hexadecyl and oleoyl respectively. ChEBI CHEBI:75268, CHEBI:34112
      A 2-acyl-1-alkyl-sn-glycero-3-phosphocholine betaine in which the alkyl and the acyl groups at positions 1 and 2 are hexadecyl and oleoyl respectively. ChEBI https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:75268
      A phosphatidylcholine (O-16:0/18:1) in which the alkyl and the acyl groups at positions 1 and 2 are hexadecyl and oleoyl respectively. ChEBI CHEBI:34112

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

Density:
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 8
#H bond donors: 1
#Freely Rotating Bonds: 41
#Rule of 5 Violations: 2
ACD/LogP: 11.93
ACD/LogD (pH 5.5): 10.85
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 10000000.00
ACD/LogD (pH 7.4): 10.85
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 10000000.00
Polar Surface Area: 104 Å2
Polarizability:
Surface Tension:
Molar Volume:

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