ChemSpider 2D Image | O-linoelaidylcarnitine | C25H45NO4

O-linoelaidylcarnitine

  • Molecular FormulaC25H45NO4
  • Average mass423.629 Da
  • Monoisotopic mass423.334869 Da
  • ChemSpider ID28540387
  • 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-[[(9E,12E)-1-oxo-9,12-octadecadien-1-yl]oxy]-, inner salt [ACD/Index Name]
3-[(9E,12E)-9,12-Octadecadienoyloxy]-4-(trimethylammonio)butanoat [German] [ACD/IUPAC Name]
3-[(9E,12E)-9,12-Octadecadienoyloxy]-4-(trimethylammonio)butanoate [ACD/IUPAC Name]
3-[(9E,12E)-9,12-Octadecadienoyloxy]-4-(triméthylammonio)butanoate [French] [ACD/IUPAC Name]
O-linoelaidylcarnitine
3-(octadeca-9,12-dienoyloxy)-4-(trimethylazaniumyl)butanoate
3-[(9E,12E)-octadeca-9,12-dienoyloxy]-4-(trimethylaminio)butanoate
3-[(9E,12E)-octadeca-9,12-dienoyloxy]-4-(trimethylammonio)butanoate
3-[(9E,12E)-octadeca-9,12-dienoyloxy]-4-(trimethylazaniumyl)butanoate
Acylcarnitine C18:2
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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

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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