ChemSpider 2D Image | 1-Palmitoyl-2-arachidonyl-sn-glycerol | C39H76O5

1-Palmitoyl-2-arachidonyl-sn-glycerol

  • Molecular FormulaC39H76O5
  • Average mass625.018 Da
  • Monoisotopic mass624.569275 Da
  • ChemSpider ID7822660

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

1-Palmitoyl-2-arachidonyl-sn-glycerol
(2S)-1-Hydroxy-3-(palmitoyloxy)-2-propanyl icosanoate [ACD/IUPAC Name]
(2S)-1-Hydroxy-3-(palmitoyloxy)-2-propanyl-icosanoat [German] [ACD/IUPAC Name]
1-hexadecanoyl-2-eicosanoyl-sn-glycerol
DG(16:0/20:0/0:0)
DG(16:0/20:0/0:0)[iso2]
Eicosanoic acid, (1S)-2-hydroxy-1-[[(1-oxohexadecyl)oxy]methyl]ethyl ester [ACD/Index Name]
Icosanoate de (2S)-1-hydroxy-3-(palmitoyloxy)-2-propanyle [French] [ACD/IUPAC Name]
(2S)-1-(hexadecanoyloxy)-3-hydroxypropan-2-yl icosanoate
DAG(16:0/20:0)
More...

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

EPA Pesticide Chemical Code 079011 [DBID]
LMGL02010042 [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: 662.3±22.0 °C at 760 mmHg
Vapour Pressure: 0.0±4.6 mmHg at 25°C
Enthalpy of Vaporization: 111.5±6.0 kJ/mol
Flash Point: 181.8±15.8 °C
Index of Refraction: 1.467
Molar Refractivity: 187.8±0.3 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 38
#Rule of 5 Violations: 2
ACD/LogP: 16.47
ACD/LogD (pH 5.5): 15.23
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 10000000.00
ACD/LogD (pH 7.4): 15.23
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 10000000.00
Polar Surface Area: 73 Å2
Polarizability: 74.4±0.5 10-24cm3
Surface Tension: 35.0±3.0 dyne/cm
Molar Volume: 677.1±3.0 cm3

Click to predict properties on the Chemicalize site


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