ChemSpider 2D Image | 1-[(9Z)-hexadecenoyl]-sn-glycero-3-phosphocholine | C24H48NO7P


  • Molecular FormulaC24H48NO7P
  • Average mass493.614 Da
  • Monoisotopic mass493.316833 Da
  • ChemSpider ID24766525
  • 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-[(9Z)-9-Hexadecenoyloxy]-2-hydroxypropyl 2-(trimethylammonio)ethyl phosphate [ACD/IUPAC Name]
(2R)-3-[(9Z)-9-Hexadecenoyloxy]-2-hydroxypropyl-2-(trimethylammonio)ethylphosphat [German] [ACD/IUPAC Name]
(7R,18Z)-4,7-Dihydroxy-N,N,N-trimethyl-10-oxo-3,5,9-trioxa-4-phosphapentacos-18-en-1-aminium inner salt 4-oxide
76790-27-7 [RN]
Ethanaminium, 2-[[hydroxy[(2R)-2-hydroxy-3-[[(9Z)-1-oxo-9-hexadecen-1-yl]oxy]propoxy]phosphinyl]oxy]-N,N,N-trimethyl-, inner salt [ACD/Index Name]
Phosphate de (2R)-3-[(9Z)-9-hexadecenoyloxy]-2-hydroxypropyle et de 2-(triméthylammonio)éthyle [French] [ACD/IUPAC Name]
(2-{[(2R)-3-[(9Z)-hexadec-9-enoyloxy]-2-hydroxypropyl phosphonato]oxy}ethyl)trimethylazanium
(2R)-3-[(9Z)-hexadec-9-enoyloxy]-2-hydroxypropyl 2-(trimethylammonio)ethyl phosphate

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

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 8
#H bond donors: 2
#Freely Rotating Bonds: 23
#Rule of 5 Violations: 0
ACD/LogP: 2.32
ACD/LogD (pH 5.5): 0.63
ACD/BCF (pH 5.5): 2.46
ACD/KOC (pH 5.5): 98.08
ACD/LogD (pH 7.4): 0.63
ACD/BCF (pH 7.4): 2.46
ACD/KOC (pH 7.4): 98.09
Polar Surface Area: 115 Å2
Surface Tension:
Molar Volume:

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