ChemSpider 2D Image | 3-[(9E,12E)-9,12-Octadecadienoyloxy]-2-[(1E,11E)-1,11-octadecadien-1-yloxy]propyl 2-(trimethylammonio)ethyl phosphate | C44H82NO7P

3-[(9E,12E)-9,12-Octadecadienoyloxy]-2-[(1E,11E)-1,11-octadecadien-1-yloxy]propyl 2-(trimethylammonio)ethyl phosphate

  • Molecular FormulaC44H82NO7P
  • Average mass768.098 Da
  • Monoisotopic mass767.582886 Da
  • ChemSpider ID59695036

  • Double-bond stereo - Double-bond stereo

More details:

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

3-[(9E,12E)-9,12-Octadecadienoyloxy]-2-[(1E,11E)-1,11-octadecadien-1-yloxy]propyl 2-(trimethylammonio)ethyl phosphate [ACD/IUPAC Name]
3-[(9E,12E)-9,12-Octadecadienoyloxy]-2-[(1E,11E)-1,11-octadecadien-1-yloxy]propyl-2-(trimethylammonio)ethylphosphat [German] [ACD/IUPAC Name]
Ethanaminium, 2-[[hydroxy[2-[(1E,11E)-1,11-octadecadien-1-yloxy]-3-[[(9E,12E)-1-oxo-9,12-octadecadien-1-yl]oxy]propoxy]phosphinyl]oxy]-N,N,N-trimethyl-, inner salt [ACD/Index Name]
Phosphate de 3-[(9E,12E)-9,12-octadecadienoyloxy]-2-[(1E,11E)-1,11-octadécadién-1-yloxy]propyle et de 2-(triméthylammonio)éthyle [French] [ACD/IUPAC Name]
1-Linoleoyl-2-(1-enyl-vaccenoyl)-sn-glycero-3-phosphocholine
GPCho(18:2/18:1)
GPCho(18:2n6/18:1n7)
GPCho(18:2w6/18:1w7)
GPCho(36:3)
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: 8
#H bond donors: 1
#Freely Rotating Bonds: 40
#Rule of 5 Violations: 2
ACD/LogP: 11.96
ACD/LogD (pH 5.5): 9.15
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 4256743.00
ACD/LogD (pH 7.4): 9.15
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 4256897.50
Polar Surface Area: 104 Å2
Polarizability:
Surface Tension:
Molar Volume:

Click to predict properties on the Chemicalize site


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