ChemSpider 2D Image | DG(20:1(11Z)/16:0/0:0) | C39H74O5

DG(20:1(11Z)/16:0/0:0)

  • Molecular FormulaC39H74O5
  • Average mass623.002 Da
  • Monoisotopic mass622.553650 Da
  • ChemSpider ID24766112

  • 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-(palmitoyloxy)propyle [French] [ACD/IUPAC Name]
(2S)-3-Hydroxy-2-(palmitoyloxy)propyl (11Z)-11-icosenoate [ACD/IUPAC Name]
(2S)-3-Hydroxy-2-(palmitoyloxy)propyl-(11Z)-11-icosenoat [German] [ACD/IUPAC Name]
11-Eicosenoic acid, (2S)-3-hydroxy-2-[(1-oxohexadecyl)oxy]propyl ester, (11Z)- [ACD/Index Name]
DG(20:1(11Z)/16:0/0:0)
(2S)-2-(hexadecanoyloxy)-3-hydroxypropyl (11Z)-icos-11-enoate
1-Eicosenoyl-2-palmitoyl-sn-glycerol
DAG(20:1/16:0)
DAG(20:1n9/16:0)
DAG(20:1w9/16:0)
More...

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: 661.5±22.0 °C at 760 mmHg
Vapour Pressure: 0.0±4.5 mmHg at 25°C
Enthalpy of Vaporization: 111.4±6.0 kJ/mol
Flash Point: 182.2±15.8 °C
Index of Refraction: 1.472
Molar Refractivity: 187.8±0.3 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 37
#Rule of 5 Violations: 2
ACD/LogP: 15.95
ACD/LogD (pH 5.5): 14.62
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 10000000.00
ACD/LogD (pH 7.4): 14.62
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 10000000.00
Polar Surface Area: 73 Å2
Polarizability: 74.5±0.5 10-24cm3
Surface Tension: 35.3±3.0 dyne/cm
Molar Volume: 670.8±3.0 cm3

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