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Search term: 59662033 (Found by CSID)
ChemSpider 2D Image | 3-[(9Z,12Z,15Z)-9,12,15-Octadecatrienoyloxy]-2-(stearoyloxy)propyl (11Z,14Z)-11,14-icosadienoate | C59H104O6

3-[(9Z,12Z,15Z)-9,12,15-Octadecatrienoyloxy]-2-(stearoyloxy)propyl (11Z,14Z)-11,14-icosadienoate

  • Molecular FormulaC59H104O6
  • Average mass909.453 Da
  • Monoisotopic mass908.783264 Da
  • ChemSpider ID59662033

  • 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

(11Z,14Z)-11,14-Icosadiénoate de 3-[(9Z,12Z,15Z)-9,12,15-octadecatrienoyloxy]-2-(stearoyloxy)propyle [French] [ACD/IUPAC Name]
11,14-Eicosadienoic acid, 3-[[(9Z,12Z,15Z)-1-oxo-9,12,15-octadecatrien-1-yl]oxy]-2-[(1-oxooctadecyl)oxy]propyl ester, (11Z,14Z)- [ACD/Index Name]
3-[(9Z,12Z,15Z)-9,12,15-Octadecatrienoyloxy]-2-(stearoyloxy)propyl (11Z,14Z)-11,14-icosadienoate [ACD/IUPAC Name]
3-[(9Z,12Z,15Z)-9,12,15-Octadecatrienoyloxy]-2-(stearoyloxy)propyl-(11Z,14Z)-11,14-icosadienoat [German] [ACD/IUPAC Name]
(2S)-3-[(9Z,12Z,15Z)-octadeca-9,12,15-trienoyloxy]-2-(octadecanoyloxy)propyl (11Z,14Z)-icosa-11,14-dienoate
1-(11Z,14Z-Eicosadienoyl)-2-octadecanoyl-3-(9Z,12Z,15Z-octadeatrienoyl)-glycerol
1-Eicosadienoyl-2-stearoyl-3-a-linolenoyl-glycerol
TAG(20:2/18:0/18:3)
TAG(20:2n6/18:0/18:3)
TAG(20:2w6/18:0/18:3)
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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: 0.9±0.1 g/cm3
Boiling Point: 834.3±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.1 mmHg at 25°C
Enthalpy of Vaporization: 121.2±3.0 kJ/mol
Flash Point: 307.0±32.9 °C
Index of Refraction: 1.484
Molar Refractivity: 281.0±0.3 cm3
#H bond acceptors: 6
#H bond donors: 0
#Freely Rotating Bonds: 53
#Rule of 5 Violations: 2
ACD/LogP: 23.58
ACD/LogD (pH 5.5): 21.32
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 10000000.00
ACD/LogD (pH 7.4): 21.32
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 10000000.00
Polar Surface Area: 79 Å2
Polarizability: 111.4±0.5 10-24cm3
Surface Tension: 35.0±3.0 dyne/cm
Molar Volume: 981.3±3.0 cm3

Click to predict properties on the Chemicalize site


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