ChemSpider 2D Image | Methyl (9Z,14Z)-12,13,16-trihydroxy-9,14-octadecadienoate | C19H34O5

Methyl (9Z,14Z)-12,13,16-trihydroxy-9,14-octadecadienoate

  • Molecular FormulaC19H34O5
  • Average mass342.470 Da
  • Monoisotopic mass342.240631 Da
  • ChemSpider ID71299158

  • Double-bond stereo - Double-bond stereo

More details:

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

(9Z,14Z)-12,13,16-Trihydroxy-9,14-octadécadiénoate de méthyle [French] [ACD/IUPAC Name]
9,14-Octadecadienoic acid, 12,13,16-trihydroxy-, methyl ester, (9Z,14Z)- [ACD/Index Name]
Methyl (9Z,14Z)-12,13,16-trihydroxy-9,14-octadecadienoate [ACD/IUPAC Name]
Methyl-(9Z,14Z)-12,13,16-trihydroxy-9,14-octadecadienoat [German] [ACD/IUPAC Name]
Compound NP-021194
methyl (9Z,14Z)-12,13,16-trihydroxyoctadeca-9,14-dienoate

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.0±0.1 g/cm3
Boiling Point: 496.4±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.9 mmHg at 25°C
Enthalpy of Vaporization: 88.0±6.0 kJ/mol
Flash Point: 166.5±22.2 °C
Index of Refraction: 1.503
Molar Refractivity: 96.4±0.3 cm3
#H bond acceptors: 5
#H bond donors: 3
#Freely Rotating Bonds: 15
#Rule of 5 Violations: 0
ACD/LogP: 3.00
ACD/LogD (pH 5.5): 2.77
ACD/BCF (pH 5.5): 75.27
ACD/KOC (pH 5.5): 767.17
ACD/LogD (pH 7.4): 2.77
ACD/BCF (pH 7.4): 75.27
ACD/KOC (pH 7.4): 767.17
Polar Surface Area: 87 Å2
Polarizability: 38.2±0.5 10-24cm3
Surface Tension: 41.7±3.0 dyne/cm
Molar Volume: 326.5±3.0 cm3

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