ChemSpider 2D Image | O-linoleoylcarnitine | C25H45NO4

O-linoleoylcarnitine

  • Molecular FormulaC25H45NO4
  • Average mass423.629 Da
  • Monoisotopic mass423.334869 Da
  • ChemSpider ID28639188

  • Double-bond stereo - Double-bond stereo

More details:

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

1-Propanaminium, 3-carboxy-N,N,N-trimethyl-2-[[(9Z,12Z)-1-oxo-9,12-octadecadien-1-yl]oxy]-, inner salt [ACD/Index Name]
3-[(9Z,12Z)-9,12-Octadecadienoyloxy]-4-(trimethylammonio)butanoat [German] [ACD/IUPAC Name]
3-[(9Z,12Z)-9,12-Octadecadienoyloxy]-4-(trimethylammonio)butanoate [ACD/IUPAC Name]
3-[(9Z,12Z)-9,12-Octadecadienoyloxy]-4-(triméthylammonio)butanoate [French] [ACD/IUPAC Name]
O-linoleoylcarnitine
(9Z,12Z)-octadeca-9,12-dienoylcarnitine
3-[(9Z,12Z)-octadeca-9,12-dienoyloxy]-4-(trimethylammonio)butanoate
3-[(9Z,12Z)-octadeca-9,12-dienoyloxy]-4-(trimethylazaniumyl)butanoate
9cis,12cis-octadecadienoylcarnitine
linoleylcarnitine

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: 5
#H bond donors: 1
#Freely Rotating Bonds: 20
#Rule of 5 Violations: 0
ACD/LogP: 3.32
ACD/LogD (pH 5.5): 2.40
ACD/BCF (pH 5.5): 54.84
ACD/KOC (pH 5.5): 904.19
ACD/LogD (pH 7.4): 2.40
ACD/BCF (pH 7.4): 55.15
ACD/KOC (pH 7.4): 909.35
Polar Surface Area: 66 Å2
Polarizability:
Surface Tension:
Molar Volume:

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