ChemSpider 2D Image | (11Z)-2-{[(9E)-9-Octadecenoyloxy]methyl}-3-oxo-11-icosen-1-yl 2-(trimethylammonio)ethyl phosphate | C44H84NO7P

(11Z)-2-{[(9E)-9-Octadecenoyloxy]methyl}-3-oxo-11-icosen-1-yl 2-(trimethylammonio)ethyl phosphate

  • Molecular FormulaC44H84NO7P
  • Average mass770.114 Da
  • Monoisotopic mass769.598511 Da
  • ChemSpider ID32821275

  • Double-bond stereo - Double-bond stereo

More details:

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

(11Z)-2-{[(9E)-9-Octadecenoyloxy]methyl}-3-oxo-11-icosen-1-yl 2-(trimethylammonio)ethyl phosphate [ACD/IUPAC Name]
(11Z)-2-{[(9E)-9-Octadecenoyloxy]methyl}-3-oxo-11-icosen-1-yl-2-(trimethylammonio)ethylphosphat [German] [ACD/IUPAC Name]
Ethanaminium, 2-[[hydroxy[[(11Z)-3-oxo-2-[[[(9E)-1-oxo-9-octadecen-1-yl]oxy]methyl]-11-eicosen-1-yl]oxy]phosphinyl]oxy]-N,N,N-trimethyl-, inner salt [ACD/Index Name]
Phosphate de (11Z)-2-{[(9E)-9-octadecenoyloxy]méthyl}-3-oxo-11-icosén-1-yle et de 2-(triméthylammonio)éthyle [French] [ACD/IUPAC Name]
(E,E)-(7-Oleoyl-4-oxido-10-oxo-3,5,9-trioxa-4-phosphaheptacos-18-enyl)trimethylammonium 4-oxide
52088-89-8 [RN]

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: 41
#Rule of 5 Violations: 2
ACD/LogP: 12.13
ACD/LogD (pH 5.5): 9.86
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 10000000.00
ACD/LogD (pH 7.4): 9.86
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 10000000.00
Polar Surface Area: 112 Å2
Polarizability:
Surface Tension:
Molar Volume:

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