ChemSpider 2D Image | DG(20:1(11Z)/18:3(9Z,12Z,15Z)/0:0) | C41H72O5

DG(20:1(11Z)/18:3(9Z,12Z,15Z)/0:0)

  • Molecular FormulaC41H72O5
  • Average mass645.007 Da
  • Monoisotopic mass644.537964 Da
  • ChemSpider ID24766119

  • 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)-11-Icosénoate de (2S)-3-hydroxy-2-[(9Z,12Z,15Z)-9,12,15-octadecatrienoyloxy]propyle [French] [ACD/IUPAC Name]
(2S)-3-Hydroxy-2-[(9Z,12Z,15Z)-9,12,15-octadecatrienoyloxy]propyl (11Z)-11-icosenoate [ACD/IUPAC Name]
(2S)-3-Hydroxy-2-[(9Z,12Z,15Z)-9,12,15-octadecatrienoyloxy]propyl-(11Z)-11-icosenoat [German] [ACD/IUPAC Name]
11-Eicosenoic acid, (2S)-3-hydroxy-2-[[(9Z,12Z,15Z)-1-oxo-9,12,15-octadecatrien-1-yl]oxy]propyl ester, (11Z)- [ACD/Index Name]
DG(20:1(11Z)/18:3(9Z,12Z,15Z)/0:0)
(2S)-3-hydroxy-2-[(9Z,12Z,15Z)-octadeca-9,12,15-trienoyloxy]propyl (11Z)-icos-11-enoate
1-Eicosenoyl-2-a-linolenoyl-sn-glycerol
1-Eicosenoyl-2-α-linolenoyl-sn-glycerol
DAG(20:1/18:3)
DAG(20:1n9/18:3n3)
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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: 689.2±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±4.9 mmHg at 25°C
Enthalpy of Vaporization: 115.5±6.0 kJ/mol
Flash Point: 190.3±22.2 °C
Index of Refraction: 1.488
Molar Refractivity: 197.3±0.3 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 36
#Rule of 5 Violations: 2
ACD/LogP: 15.30
ACD/LogD (pH 5.5): 12.86
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 10000000.00
ACD/LogD (pH 7.4): 12.86
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 10000000.00
Polar Surface Area: 73 Å2
Polarizability: 78.2±0.5 10-24cm3
Surface Tension: 35.9±3.0 dyne/cm
Molar Volume: 684.6±3.0 cm3

Click to predict properties on the Chemicalize site


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