ChemSpider 2D Image | (2S)-2,3-Dihydroxypropyl (5Z,8Z,11Z)-5,8,11-icosatrienoate | C23H40O4

(2S)-2,3-Dihydroxypropyl (5Z,8Z,11Z)-5,8,11-icosatrienoate

  • Molecular FormulaC23H40O4
  • Average mass380.561 Da
  • Monoisotopic mass380.292664 Da
  • ChemSpider ID24765795

  • 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)-2,3-Dihydroxypropyl (5Z,8Z,11Z)-5,8,11-icosatrienoate [ACD/IUPAC Name]
(2S)-2,3-Dihydroxypropyl-(5Z,8Z,11Z)-5,8,11-icosatrienoat [German] [ACD/IUPAC Name]
(5Z,8Z,11Z)-5,8,11-Icosatriénoate de (2S)-2,3-dihydroxypropyle [French] [ACD/IUPAC Name]
5,8,11-Eicosatrienoic acid, (2S)-2,3-dihydroxypropyl ester, (5Z,8Z,11Z)- [ACD/Index Name]
(2S)-2,3-dihydroxypropyl (5Z,8Z,11Z)-icosa-5,8,11-trienoate
1-(5Z,8Z,11Z-Eicosatrienoyl)-rac-glycerol
1-Meadoyl-glycerol
1-Monoacylglyceride
1-Monoacylglycerol
a-Monoacylglycerol
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: 1.0±0.1 g/cm3
Boiling Point: 508.9±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.0 mmHg at 25°C
Enthalpy of Vaporization: 89.7±6.0 kJ/mol
Flash Point: 162.2±23.6 °C
Index of Refraction: 1.497
Molar Refractivity: 113.6±0.3 cm3
#H bond acceptors: 4
#H bond donors: 2
#Freely Rotating Bonds: 19
#Rule of 5 Violations: 1
ACD/LogP: 6.70
ACD/LogD (pH 5.5): 6.48
ACD/BCF (pH 5.5): 49348.13
ACD/KOC (pH 5.5): 79620.57
ACD/LogD (pH 7.4): 6.48
ACD/BCF (pH 7.4): 49348.07
ACD/KOC (pH 7.4): 79620.48
Polar Surface Area: 67 Å2
Polarizability: 45.0±0.5 10-24cm3
Surface Tension: 38.2±3.0 dyne/cm
Molar Volume: 387.9±3.0 cm3

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