ChemSpider 2D Image | 1-palmityl-2-arachidonoyl-sn-glycerol | C39H70O4

1-palmityl-2-arachidonoyl-sn-glycerol

  • Molecular FormulaC39H70O4
  • Average mass602.971 Da
  • Monoisotopic mass602.527405 Da
  • ChemSpider ID26373362

  • 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

(2S)-1-(Hexadecyloxy)-3-hydroxy-2-propanyl (5Z,8Z,11Z,14Z)-5,8,11,14-icosatetraenoate [ACD/IUPAC Name]
(2S)-1-(Hexadecyloxy)-3-hydroxy-2-propanyl-(5Z,8Z,11Z,14Z)-5,8,11,14-icosatetraenoat [German] [ACD/IUPAC Name]
(5Z,8Z,11Z,14Z)-5,8,11,14-Icosatétraénoate de (2S)-1-(hexadécyloxy)-3-hydroxy-2-propanyle [French] [ACD/IUPAC Name]
1-palmityl-2-arachidonoyl-sn-glycerol
5,8,11,14-Eicosatetraenoic acid, (1S)-2-(hexadecyloxy)-1-(hydroxymethyl)ethyl ester, (5Z,8Z,11Z,14Z)- [ACD/Index Name]
(2S)-1-(hexadecyloxy)-3-hydroxypropan-2-yl (5Z,8Z,11Z,14Z)-icosa-5,8,11,14-tetraenoate
1-hexadecyl-2-(5Z,8Z,11Z,14Z)-eicosatetraenoyl-sn-glycerol
1-hexadecyl-2-(5Z,8Z,11Z,14Z)-icosatetraenoyl-sn-glycero
1-O-hexadecyl-2-(5Z,8Z,11Z,14Z)-eicosatetraenoyl-sn-glycerol
1-O-hexadecyl-2-(5Z,8Z,11Z,14Z-eicosatetraenoyl)-sn-glycerol
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 0.9±0.1 g/cm3
Boiling Point: 660.9±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±4.5 mmHg at 25°C
Enthalpy of Vaporization: 111.3±6.0 kJ/mol
Flash Point: 184.2±25.0 °C
Index of Refraction: 1.486
Molar Refractivity: 188.0±0.3 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 34
#Rule of 5 Violations: 2
ACD/LogP: 14.82
ACD/LogD (pH 5.5): 13.23
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 10000000.00
ACD/LogD (pH 7.4): 13.23
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 10000000.00
Polar Surface Area: 56 Å2
Polarizability: 74.5±0.5 10-24cm3
Surface Tension: 34.9±3.0 dyne/cm
Molar Volume: 654.5±3.0 cm3

Click to predict properties on the Chemicalize site


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