ChemSpider 2D Image | (2R)-3-[(9E,12E)-9,12-Octadecadienoyloxy]-2-[(6E,9E,12E,15E)-6,9,12,15-octadecatetraenoyloxy]propyl 2-(trimethylammonio)ethyl phosphate | C44H76NO8P

(2R)-3-[(9E,12E)-9,12-Octadecadienoyloxy]-2-[(6E,9E,12E,15E)-6,9,12,15-octadecatetraenoyloxy]propyl 2-(trimethylammonio)ethyl phosphate

  • Molecular FormulaC44H76NO8P
  • Average mass778.050 Da
  • Monoisotopic mass777.530884 Da
  • ChemSpider ID59695024

  • 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-[(9E,12E)-9,12-Octadecadienoyloxy]-2-[(6E,9E,12E,15E)-6,9,12,15-octadecatetraenoyloxy]propyl 2-(trimethylammonio)ethyl phosphate [ACD/IUPAC Name]
(2R)-3-[(9E,12E)-9,12-Octadecadienoyloxy]-2-[(6E,9E,12E,15E)-6,9,12,15-octadecatetraenoyloxy]propyl-2-(trimethylammonio)ethylphosphat [German] [ACD/IUPAC Name]
Ethanaminium, 2-[[hydroxy[(2R)-3-[[(9E,12E)-1-oxo-9,12-octadecadien-1-yl]oxy]-2-[[(6E,9E,12E,15E)-1-oxo-6,9,12,15-octadecatetraen-1-yl]oxy]propoxy]phosphinyl]oxy]-N,N,N-trimethyl-, inner salt [ACD/Index Name]
Phosphate de (2R)-3-[(9E,12E)-9,12-octadecadienoyloxy]-2-[(6E,9E,12E,15E)-6,9,12,15-octadecatetraenoyloxy]propyle et de 2-(triméthylammonio)éthyle [French] [ACD/IUPAC Name]
1-Linoleoyl-2-stearidonoyl-sn-glycero-3-phosphocholine
GPCho(18:2/18:4)
GPCho(18:2n6/18:4n3)
GPCho(18:2w6/18:4w3)
GPCho(36:6)
LECITHIN
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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:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 9
#H bond donors: 1
#Freely Rotating Bonds: 38
#Rule of 5 Violations: 2
ACD/LogP: 9.64
ACD/LogD (pH 5.5): 7.55
ACD/BCF (pH 5.5): 449215.63
ACD/KOC (pH 5.5): 572955.69
ACD/LogD (pH 7.4): 7.55
ACD/BCF (pH 7.4): 449230.91
ACD/KOC (pH 7.4): 572975.19
Polar Surface Area: 121 Å2
Polarizability:
Surface Tension:
Molar Volume:

Click to predict properties on the Chemicalize site


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