ChemSpider 2D Image | N,N,N-Trimethyl-2-[(9Z)-9-octadecenoyloxy]ethanaminium | C23H46NO2

N,N,N-Trimethyl-2-[(9Z)-9-octadecenoyloxy]ethanaminium

  • Molecular FormulaC23H46NO2
  • Average mass368.616 Da
  • Monoisotopic mass368.352295 Da
  • ChemSpider ID58827254

  • Charge - Charge

    Double-bond stereo - Double-bond stereo

More details:

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

Ethanaminium, N,N,N-trimethyl-2-[[(9Z)-1-oxo-9-octadecen-1-yl]oxy]- [ACD/Index Name]
N,N,N-Trimethyl-2-[(9Z)-9-octadecenoyloxy]ethanaminium [German] [ACD/IUPAC Name]
N,N,N-Trimethyl-2-[(9Z)-9-octadecenoyloxy]ethanaminium [ACD/IUPAC Name]
N,N,N-Triméthyl-2-[(9Z)-9-octadecenoyloxy]éthanaminium [French] [ACD/IUPAC Name]
(9Z)-octadecenoylcholine
choline (9Z)-octadecenoate
choline oleate
N,N,N-trimethyl-2-{[(9Z)-octadec-9-enoyl]oxy}ethan-1-aminium
oleoylcholine
  • Miscellaneous

    • Chemical Class:

      An acylcholine obtained by formal condensation of the carboxy group of oleic acid with the hydroxy group of choline. ChEBI CHEBI:133693

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: 3
#H bond donors: 0
#Freely Rotating Bonds: 19
#Rule of 5 Violations: 0
ACD/LogP: 4.08
ACD/LogD (pH 5.5): 3.52
ACD/BCF (pH 5.5): 280.49
ACD/KOC (pH 5.5): 1967.11
ACD/LogD (pH 7.4): 3.52
ACD/BCF (pH 7.4): 280.49
ACD/KOC (pH 7.4): 1967.11
Polar Surface Area: 26 Å2
Polarizability:
Surface Tension:
Molar Volume:

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