ChemSpider 2D Image | 2,3-Bis[(9Z)-9-octadecenoyloxy]propyl (11Z,14Z)-11,14-icosadienoate | C59H106O6

2,3-Bis[(9Z)-9-octadecenoyloxy]propyl (11Z,14Z)-11,14-icosadienoate

  • Molecular FormulaC59H106O6
  • Average mass911.469 Da
  • Monoisotopic mass910.798950 Da
  • ChemSpider ID7823457

  • 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 2,3-bis[(9Z)-9-octadecenoyloxy]propyle [French] [ACD/IUPAC Name]
11,14-Eicosadienoic acid, 2,3-bis[[(9Z)-1-oxo-9-octadecen-1-yl]oxy]propyl ester, (11Z,14Z)- [ACD/Index Name]
2,3-Bis[(9Z)-9-octadecenoyloxy]propyl (11Z,14Z)-11,14-icosadienoate [ACD/IUPAC Name]
2,3-Bis[(9Z)-9-octadecenoyloxy]propyl-(11Z,14Z)-11,14-icosadienoat [German] [ACD/IUPAC Name]
(2S)-2,3-bis[(9Z)-octadec-9-enoyloxy]propyl (11Z,14Z)-icosa-11,14-dienoate
1,2-di-(9Z-octadecenoyl)-3-(11Z,14Z-eicosadienoyl)-sn-glycerol
1-Oleoyl-2-oleoyl-3-eicosadienoyl-glycerol
TAG(18:1/18:1/20:2)
TAG(18:1n9/18:1n9/20:2n6)
TAG(18:1w9/18:1w9/20:2w6)
More...

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

LMGL03010545 [DBID]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 0.9±0.1 g/cm3
Boiling Point: 835.0±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.1 mmHg at 25°C
Enthalpy of Vaporization: 121.3±3.0 kJ/mol
Flash Point: 306.9±31.5 °C
Index of Refraction: 1.481
Molar Refractivity: 280.9±0.3 cm3
#H bond acceptors: 6
#H bond donors: 0
#Freely Rotating Bonds: 54
#Rule of 5 Violations: 2
ACD/LogP: 24.26
ACD/LogD (pH 5.5): 22.11
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 10000000.00
ACD/LogD (pH 7.4): 22.11
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: 34.9±3.0 dyne/cm
Molar Volume: 987.7±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement