ChemSpider 2D Image | Methyl (11Z)-11,14,17-icosatrienoate | C21H36O2

Methyl (11Z)-11,14,17-icosatrienoate

  • Molecular FormulaC21H36O2
  • Average mass320.509 Da
  • Monoisotopic mass320.271515 Da
  • ChemSpider ID30989772

  • Double-bond stereo - Double-bond stereo

More details:

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

(11Z)-11,14,17-Icosatriénoate de méthyle [French] [ACD/IUPAC Name]
11,14,17-Eicosatrienoic acid, methyl ester, (11Z)- [ACD/Index Name]
Methyl (11Z)-11,14,17-icosatrienoate [ACD/IUPAC Name]
Methyl-(11Z)-11,14,17-icosatrienoat [German] [ACD/IUPAC Name]
55682-88-7 [RN]
CIS-11,14,17-EICOSATRIENOIC ACID METHYL ESTER

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

Density: 0.9±0.1 g/cm3
Boiling Point: 398.6±11.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 64.9±3.0 kJ/mol
Flash Point: 95.7±17.6 °C
Index of Refraction: 1.475
Molar Refractivity: 101.3±0.3 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 16
#Rule of 5 Violations: 1
ACD/LogP: 8.02
ACD/LogD (pH 5.5): 7.12
ACD/BCF (pH 5.5): 151142.00
ACD/KOC (pH 5.5): 177411.19
ACD/LogD (pH 7.4): 7.12
ACD/BCF (pH 7.4): 151142.00
ACD/KOC (pH 7.4): 177411.19
Polar Surface Area: 26 Å2
Polarizability: 40.2±0.5 10-24cm3
Surface Tension: 31.8±3.0 dyne/cm
Molar Volume: 359.5±3.0 cm3

Click to predict properties on the Chemicalize site


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