ChemSpider 2D Image | Ethyl 12-oxooctadecanoate | C20H38O3

Ethyl 12-oxooctadecanoate

  • Molecular FormulaC20H38O3
  • Average mass326.514 Da
  • Monoisotopic mass326.282104 Da
  • ChemSpider ID15572053

More details:

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

12-Oxooctadécanoate d'éthyle [French] [ACD/IUPAC Name]
Ethyl 12-oxooctadecanoate [ACD/IUPAC Name]
Ethyl-12-oxooctadecanoat [German] [ACD/IUPAC Name]
Octadecanoic acid, 12-oxo-, ethyl ester [ACD/Index Name]
88472-61-1 [RN]

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

Density: 0.9±0.1 g/cm3
Boiling Point: 409.0±18.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 66.1±3.0 kJ/mol
Flash Point: 172.6±21.3 °C
Index of Refraction: 1.450
Molar Refractivity: 96.5±0.3 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 18
#Rule of 5 Violations: 1
ACD/LogP: 6.70
ACD/LogD (pH 5.5): 6.47
ACD/BCF (pH 5.5): 48957.30
ACD/KOC (pH 5.5): 79168.67
ACD/LogD (pH 7.4): 6.47
ACD/BCF (pH 7.4): 48957.30
ACD/KOC (pH 7.4): 79168.67
Polar Surface Area: 43 Å2
Polarizability: 38.3±0.5 10-24cm3
Surface Tension: 32.5±3.0 dyne/cm
Molar Volume: 359.3±3.0 cm3

Click to predict properties on the Chemicalize site


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