ChemSpider 2D Image | 1,3-Dihydroxy-2-propanyl (11Z,14Z,17Z)-11,14,17-icosatrienoate | C23H40O4

1,3-Dihydroxy-2-propanyl (11Z,14Z,17Z)-11,14,17-icosatrienoate

  • Molecular FormulaC23H40O4
  • Average mass380.561 Da
  • Monoisotopic mass380.292664 Da
  • ChemSpider ID24765774

  • Double-bond stereo - Double-bond stereo

More details:

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

(11Z,14Z,17Z)-11,14,17-Icosatriénoate de 1,3-dihydroxy-2-propanyle [French] [ACD/IUPAC Name]
1,3-Dihydroxy-2-propanyl (11Z,14Z,17Z)-11,14,17-icosatrienoate [ACD/IUPAC Name]
1,3-Dihydroxy-2-propanyl-(11Z,14Z,17Z)-11,14,17-icosatrienoat [German] [ACD/IUPAC Name]
11,14,17-Eicosatrienoic acid, 2-hydroxy-1-(hydroxymethyl)ethyl ester, (11Z,14Z,17Z)- [ACD/Index Name]
1,3-dihydroxypropan-2-yl (11Z,14Z,17Z)-icosa-11,14,17-trienoate
MG(0:0/20:3(11Z,14Z,17Z)/0:0)

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±45.0 °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±22.2 °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: 6.80
ACD/LogD (pH 5.5): 5.96
ACD/BCF (pH 5.5): 19917.37
ACD/KOC (pH 5.5): 41588.82
ACD/LogD (pH 7.4): 5.96
ACD/BCF (pH 7.4): 19917.35
ACD/KOC (pH 7.4): 41588.77
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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