ChemSpider 2D Image | (2R)-3-[(9E)-9-Hexadecenoyloxy]-2-[(9E,12E)-9,12-octadecadienoyloxy]propyl 2-(trimethylammonio)ethyl phosphate | C42H78NO8P

(2R)-3-[(9E)-9-Hexadecenoyloxy]-2-[(9E,12E)-9,12-octadecadienoyloxy]propyl 2-(trimethylammonio)ethyl phosphate

  • Molecular FormulaC42H78NO8P
  • Average mass756.044 Da
  • Monoisotopic mass755.546509 Da
  • ChemSpider ID59694929

  • 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)-9-Hexadecenoyloxy]-2-[(9E,12E)-9,12-octadecadienoyloxy]propyl 2-(trimethylammonio)ethyl phosphate [ACD/IUPAC Name]
(2R)-3-[(9E)-9-Hexadecenoyloxy]-2-[(9E,12E)-9,12-octadecadienoyloxy]propyl-2-(trimethylammonio)ethylphosphat [German] [ACD/IUPAC Name]
Ethanaminium, 2-[[hydroxy[(2R)-3-[[(9E)-1-oxo-9-hexadecen-1-yl]oxy]-2-[[(9E,12E)-1-oxo-9,12-octadecadien-1-yl]oxy]propoxy]phosphinyl]oxy]-N,N,N-trimethyl-, inner salt [ACD/Index Name]
Phosphate de (2R)-3-[(9E)-9-hexadecenoyloxy]-2-[(9E,12E)-9,12-octadecadienoyloxy]propyle et de 2-(triméthylammonio)éthyle [French] [ACD/IUPAC Name]
(2-{[(2R)-3-(hexadec-9-enoyloxy)-2-(octadeca-9,12-dienoyloxy)propyl phosphonato]oxy}ethyl)trimethylazanium
1-palmitoleoyl-2-linoleoyl-sn-glycero-3-phosphocholine
GPCho(16:1/18:2)
GPCho(16:1n7/18:2n6)
GPCho(16:1w7/18:2w6)
GPCho(34:3)
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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: 39
#Rule of 5 Violations: 2
ACD/LogP: 10.39
ACD/LogD (pH 5.5): 8.16
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 1230013.88
ACD/LogD (pH 7.4): 8.16
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 1230055.75
Polar Surface Area: 121 Å2
Polarizability:
Surface Tension:
Molar Volume:

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