ChemSpider 2D Image | 1,3-di-(9-octadecenoyl)-2-(9,12-octadecadienoyl)glycerol | C57H102O6

1,3-di-(9-octadecenoyl)-2-(9,12-octadecadienoyl)glycerol

  • Molecular FormulaC57H102O6
  • Average mass883.416 Da
  • Monoisotopic mass882.767639 Da
  • ChemSpider ID19476568

  • Double-bond stereo - Double-bond stereo

More details:

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

(9E,12E)-9,12-Octadécadiénoate de 1,3-bis[(9E)-9-octadecenoyloxy]-2-propanyle [French] [ACD/IUPAC Name]
1,3-Bis[(9E)-9-octadecenoyloxy]-2-propanyl (9E,12E)-9,12-octadecadienoate [ACD/IUPAC Name]
1,3-Bis[(9E)-9-octadecenoyloxy]-2-propanyl-(9E,12E)-9,12-octadecadienoat [German] [ACD/IUPAC Name]
1,3-di-(9-octadecenoyl)-2-(9,12-octadecadienoyl)glycerol
9,12-Octadecadienoic acid, 2-[[(9E)-1-oxo-9-octadecen-1-yl]oxy]-1-[[[(9E)-1-oxo-9-octadecen-1-yl]oxy]methyl]ethyl ester, (9E,12E)- [ACD/Index Name]
1,3-bis[(9E)-octadec-9-enoyloxy]propan-2-yl (9E,12E)-octadeca-9,12-dienoate
2190-19-4 [RN]
9,12-Octadecadienoic acid 2-[(1-oxo-9-octadecenyl)oxy]-1-[[(1-oxo-9-octadecenyl)oxy]methyl]ethyl ester
a,a'-Dioleolinolein
Glycerol 1,3-di-(9Z-octadecenoate) 2-(9Z,12Z-octadecadienoate)
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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: 818.0±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.0 mmHg at 25°C
Enthalpy of Vaporization: 118.9±3.0 kJ/mol
Flash Point: 302.8±34.3 °C
Index of Refraction: 1.481
Molar Refractivity: 271.6±0.3 cm3
#H bond acceptors: 6
#H bond donors: 0
#Freely Rotating Bonds: 52
#Rule of 5 Violations: 2
ACD/LogP: 23.19
ACD/LogD (pH 5.5): 21.26
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 10000000.00
ACD/LogD (pH 7.4): 21.26
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 10000000.00
Polar Surface Area: 79 Å2
Polarizability: 107.7±0.5 10-24cm3
Surface Tension: 34.9±3.0 dyne/cm
Molar Volume: 954.7±3.0 cm3

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