ChemSpider 2D Image | 3, 5-Tetradecadiencarnitine | C21H37NO4

3, 5-Tetradecadiencarnitine

  • Molecular FormulaC21H37NO4
  • Average mass367.523 Da
  • Monoisotopic mass367.272247 Da
  • ChemSpider ID30776713

  • Double-bond stereo - Double-bond stereo

    defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(4S)-4-[(3E,5E)-3,5-Tetradecadienoyloxy]-4-(trimethylammonio)butanoat [German] [ACD/IUPAC Name]
(4S)-4-[(3E,5E)-3,5-Tetradecadienoyloxy]-4-(trimethylammonio)butanoate [ACD/IUPAC Name]
(4S)-4-[(3E,5E)-3,5-Tetradecadienoyloxy]-4-(triméthylammonio)butanoate [French] [ACD/IUPAC Name]
1-Propanaminium, 3-carboxy-N,N,N-trimethyl-1-[[(3E,5E)-1-oxo-3,5-tetradecadien-1-yl]oxy]-, inner salt, (1S)- [ACD/Index Name]
3, 5-Tetradecadiencarnitine
(3E,5E)-tetradecadiencarnitine
(3E,5E)-tetradecadienoylcarnitine
(4S)-4-[(3E,5E)-tetradeca-3,5-dienoyloxy]-4-(trimethylaminio)butanoate
(4S)-4-[(3E,5E)-tetradeca-3,5-dienoyloxy]-4-(trimethylazaniumyl)butanoate
(E,E)-3, 5-tetradecadiencarnitine

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: 16
#Rule of 5 Violations: 0
ACD/LogP: 2.26
ACD/LogD (pH 5.5): 1.49
ACD/BCF (pH 5.5): 11.16
ACD/KOC (pH 5.5): 288.41
ACD/LogD (pH 7.4): 1.50
ACD/BCF (pH 7.4): 11.35
ACD/KOC (pH 7.4): 293.22
Polar Surface Area: 66 Å2
Polarizability:
Surface Tension:
Molar Volume:

Click to predict properties on the Chemicalize site


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