ChemSpider 2D Image | 3-(Heptadecanoyloxy)-2-[(9Z,12Z)-9,12-octadecadienoyloxy]propyl 2-{tris[(~2~H_3_)methyl]ammonio}ethyl phosphate | C43H73D9NO8P

3-(Heptadecanoyloxy)-2-[(9Z,12Z)-9,12-octadecadienoyloxy]propyl 2-{tris[(2H3)methyl]ammonio}ethyl phosphate

  • Molecular FormulaC43H73D9NO8P
  • Average mass781.142 Da
  • Monoisotopic mass780.634277 Da
  • ChemSpider ID49072140
  • Double-bond stereo - Double-bond stereo

    Non-standard isotope - Non-standard isotope


More details:






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

3-(Heptadecanoyloxy)-2-[(9Z,12Z)-9,12-octadecadienoyloxy]propyl 2-{tris[(2H3)methyl]ammonio}ethyl phosphate [ACD/IUPAC Name]
3-(Heptadecanoyloxy)-2-[(9Z,12Z)-9,12-octadecadienoyloxy]propyl-2-{tris[(2H3)methyl]ammonio}ethylphosphat [German] [ACD/IUPAC Name]
Ethanaminium, 2-[[hydroxy[3-[(1-oxoheptadecyl)oxy]-2-[[(9Z,12Z)-1-oxo-9,12-octadecadien-1-yl]oxy]propoxy]phosphinyl]oxy]-N,N,N-tri(methyl-d3)-, inner salt [ACD/Index Name]
Phosphate de 3-(heptadecanoyloxy)-2-[(9Z,12Z)-9,12-octadecadienoyloxy]propyle et de 2-{tris[(2H3)méthyl]ammonio}éthyle [French] [ACD/IUPAC Name]
2-Linoleoyl-1-palmitoyl-rac-glycero-3-phosphocholine-(trimethyl-d9)

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

Density:
Boiling Point:
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Enthalpy of Vaporization:
Flash Point:
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 9
#H bond donors: 1
#Freely Rotating Bonds: 41
#Rule of 5 Violations: 2
ACD/LogP: 11.44
ACD/LogD (pH 5.5): 10.23
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 10000000.00
ACD/LogD (pH 7.4): 10.23
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 10000000.00
Polar Surface Area: 121 Å2
Polarizability:
Surface Tension:
Molar Volume:

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