ChemSpider 2D Image | (2E)-hexadecenoylcarnitine | C23H43NO4

(2E)-hexadecenoylcarnitine

  • Molecular FormulaC23H43NO4
  • Average mass397.592 Da
  • Monoisotopic mass397.319214 Da
  • ChemSpider ID26948132

  • Double-bond stereo - Double-bond stereo

More details:

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

(2E)-hexadecenoylcarnitine
1-Propanaminium, 3-carboxy-N,N,N-trimethyl-2-[[(2E)-1-oxo-2-hexadecen-1-yl]oxy]-, inner salt [ACD/Index Name]
3-[(2E)-2-Hexadecenoyloxy]-4-(trimethylammonio)butanoat [German] [ACD/IUPAC Name]
3-[(2E)-2-Hexadecenoyloxy]-4-(trimethylammonio)butanoate [ACD/IUPAC Name]
3-[(2E)-2-Hexadecenoyloxy]-4-(triméthylammonio)butanoate [French] [ACD/IUPAC Name]
(2E)-Hexadecenoyl-carnitine
3-(hexadec-2-enoyloxy)-4-(trimethylazaniumyl)butanoate
3-[(2E)-hexadec-2-enoyloxy]-4-(trimethylaminio)butanoate
3-[(2E)-HEXADEC-2-ENOYLOXY]-4-(TRIMETHYLAMMONIO)BUTANOATE
3-[(2E)-hexadec-2-enoyloxy]-4-(trimethylazaniumyl)butanoate
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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, 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: 19
#Rule of 5 Violations: 0
ACD/LogP: 3.02
ACD/LogD (pH 5.5): 2.79
ACD/BCF (pH 5.5): 108.06
ACD/KOC (pH 5.5): 1469.47
ACD/LogD (pH 7.4): 2.79
ACD/BCF (pH 7.4): 108.65
ACD/KOC (pH 7.4): 1477.46
Polar Surface Area: 66 Å2
Polarizability:
Surface Tension:
Molar Volume:

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