ChemSpider 2D Image | DG(20:0/18:0/0:0) | C41H80O5

DG(20:0/18:0/0:0)

  • Molecular FormulaC41H80O5
  • Average mass653.071 Da
  • Monoisotopic mass652.600586 Da
  • ChemSpider ID2497484

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(2S)-3-Hydroxy-2-(stearoyloxy)propyl icosanoate [ACD/IUPAC Name]
(2S)-3-Hydroxy-2-(stearoyloxy)propyl-icosanoat [German] [ACD/IUPAC Name]
DG(20:0/18:0/0:0)
Eicosanoic acid, (2S)-3-hydroxy-2-[(1-oxooctadecyl)oxy]propyl ester [ACD/Index Name]
Icosanoate de (2S)-3-hydroxy-2-(stearoyloxy)propyle [French] [ACD/IUPAC Name]
(2S)-3-hydroxy-2-(octadecanoyloxy)propyl icosanoate
131907-57-8 [RN]
1-Arachidonyl-2-stearoyl-sn-glycerol
1-eicosanoyl-2-octadecanoyl-sn-glycerol
DAG(20:0/18:0)
More...

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

LMGL02010008 [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: 682.3±22.0 °C at 760 mmHg
Vapour Pressure: 0.0±4.8 mmHg at 25°C
Enthalpy of Vaporization: 114.5±6.0 kJ/mol
Flash Point: 185.2±15.8 °C
Index of Refraction: 1.467
Molar Refractivity: 197.0±0.3 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 40
#Rule of 5 Violations: 2
ACD/LogP: 17.53
ACD/LogD (pH 5.5): 16.05
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 10000000.00
ACD/LogD (pH 7.4): 16.05
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 10000000.00
Polar Surface Area: 73 Å2
Polarizability: 78.1±0.5 10-24cm3
Surface Tension: 35.0±3.0 dyne/cm
Molar Volume: 710.2±3.0 cm3

Click to predict properties on the Chemicalize site


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