ChemSpider 2D Image | 1-(1Z-octadecenyl)-2-hexadecanoyl-sn-glycero-3-phosphocholine | C42H84NO7P

1-(1Z-octadecenyl)-2-hexadecanoyl-sn-glycero-3-phosphocholine

  • Molecular FormulaC42H84NO7P
  • Average mass746.093 Da
  • Monoisotopic mass745.598511 Da
  • ChemSpider ID9300643

  • 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-[(1Z)-1-Octadecen-1-yloxy]-2-(palmitoyloxy)propyl 2-(trimethylammonio)ethyl phosphate [ACD/IUPAC Name]
(2R)-3-[(1Z)-1-Octadecen-1-yloxy]-2-(palmitoyloxy)propyl-2-(trimethylammonio)ethylphosphat [German] [ACD/IUPAC Name]
1-(1Z-octadecenyl)-2-hexadecanoyl-sn-glycero-3-phosphocholine
Ethanaminium, 2-[[hydroxy[(2R)-3-[(1Z)-1-octadecen-1-yloxy]-2-[(1-oxohexadecyl)oxy]propoxy]phosphinyl]oxy]-N,N,N-trimethyl-, inner salt [ACD/Index Name]
Phosphate de (2R)-3-[(1Z)-1-octadécén-1-yloxy]-2-(palmitoyloxy)propyle et de 2-(triméthylammonio)éthyle [French] [ACD/IUPAC Name]
(2R)-2-(hexadecanoyloxy)-3-[(1Z)-octadec-1-en-1-yloxy]propyl 2-(trimethylammonio)ethyl phosphate
1-(1Z-octadecenyl)-2-hexadecanoyl-glycero-3-phosphocholine
PC(P-18:0/16:0)
PC(P-34:0)
  • Miscellaneous

    • Chemical Class:

      A 1-<element>O</element>-(alk-1-enyl)-2-<element>O</element>-acyl-<ital>sn</ital>-glycero-3-phosphocholine in which the alkenyl group at position 1 is (1<stereo>Z</stereo>)-octadecenyl and the acyl gr oup at position 2 is hexadecanoyl respectively. ChEBI CHEBI:84826
      A 1-O-(alk-1-enyl)-2-O-acyl-sn-glycero-3-phosphocholine in which the alkenyl group at position 1 is (1Z)-octadecenyl and the acyl gr; oup at position 2 is hexadecanoyl respectively. ChEBI https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:84826
      A 1-O-(alk-1-enyl)-2-O-acyl-sn-glycero-3-phosphocholine in which the alkenyl group at position 1 is (1Z)-octadecenyl and the acyl group at position 2 is hexadecanoyl respectively. ChEBI CHEBI:84826

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: 12.51
ACD/LogD (pH 5.5): 11.33
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 10000000.00
ACD/LogD (pH 7.4): 11.33
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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