ChemSpider 2D Image | (2S)-2,3-Dihydroxypropyl (11Z)-11-octadecenoate | C21H40O4

(2S)-2,3-Dihydroxypropyl (11Z)-11-octadecenoate

  • Molecular FormulaC21H40O4
  • Average mass356.540 Da
  • Monoisotopic mass356.292664 Da
  • ChemSpider ID24765787

  • 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-Octadécénoate de (2S)-2,3-dihydroxypropyle [French] [ACD/IUPAC Name]
(2S)-2,3-Dihydroxypropyl (11Z)-11-octadecenoate [ACD/IUPAC Name]
(2S)-2,3-Dihydroxypropyl-(11Z)-11-octadecenoat [German] [ACD/IUPAC Name]
11-Octadecenoic acid, (2S)-2,3-dihydroxypropyl ester, (11Z)- [ACD/Index Name]
(2S)-2,3-dihydroxypropyl (11Z)-octadec-11-enoate
1-(11Z-Octadecenoyl)-rac-glycerol
1-Monoacylglyceride
1-Monoacylglycerol
1-Vaccenoyl-glycerol
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: 476.4±25.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.7 mmHg at 25°C
Enthalpy of Vaporization: 85.3±6.0 kJ/mol
Flash Point: 152.5±16.7 °C
Index of Refraction: 1.479
Molar Refractivity: 104.2±0.3 cm3
#H bond acceptors: 4
#H bond donors: 2
#Freely Rotating Bonds: 19
#Rule of 5 Violations: 1
ACD/LogP: 6.71
ACD/LogD (pH 5.5): 6.09
ACD/BCF (pH 5.5): 25061.05
ACD/KOC (pH 5.5): 49021.73
ACD/LogD (pH 7.4): 6.09
ACD/BCF (pH 7.4): 25061.02
ACD/KOC (pH 7.4): 49021.68
Polar Surface Area: 67 Å2
Polarizability: 41.3±0.5 10-24cm3
Surface Tension: 37.6±3.0 dyne/cm
Molar Volume: 367.7±3.0 cm3

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