ChemSpider 2D Image | Ethyl (5E,9E,12E)-5,9,12-octadecatrienoate | C20H34O2

Ethyl (5E,9E,12E)-5,9,12-octadecatrienoate

  • Molecular FormulaC20H34O2
  • Average mass306.483 Da
  • Monoisotopic mass306.255890 Da
  • ChemSpider ID28589277
  • Double-bond stereo - Double-bond stereo


More details:






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

(5E,9E,12E)-5,9,12-Octadécatriénoate d'éthyle [French] [ACD/IUPAC Name]
5,9,12-Octadecatrienoic acid, ethyl ester, (5E,9E,12E)- [ACD/Index Name]
Ethyl (5E,9E,12E)-5,9,12-octadecatrienoate [ACD/IUPAC Name]
Ethyl-(5E,9E,12E)-5,9,12-octadecatrienoat [German] [ACD/IUPAC Name]
493015-74-0 [RN]
Ethyl octadeca-5,9,12-trienoate
Pinolenic Acid ethyl ester

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 0.9±0.1 g/cm3
Boiling Point: 390.6±31.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 64.0±3.0 kJ/mol
Flash Point: 100.8±23.2 °C
Index of Refraction: 1.475
Molar Refractivity: 96.7±0.3 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 15
#Rule of 5 Violations: 1
ACD/LogP: 7.65
ACD/LogD (pH 5.5): 7.06
ACD/BCF (pH 5.5): 136320.61
ACD/KOC (pH 5.5): 164777.16
ACD/LogD (pH 7.4): 7.06
ACD/BCF (pH 7.4): 136320.61
ACD/KOC (pH 7.4): 164777.16
Polar Surface Area: 26 Å2
Polarizability: 38.3±0.5 10-24cm3
Surface Tension: 31.8±3.0 dyne/cm
Molar Volume: 343.0±3.0 cm3

Click to predict properties on the Chemicalize site






Advertisement