ChemSpider 2D Image | Octadecyl 7-methyloctanoate | C27H54O2

Octadecyl 7-methyloctanoate

  • Molecular FormulaC27H54O2
  • Average mass410.716 Da
  • Monoisotopic mass410.412384 Da
  • ChemSpider ID31150023

More details:

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

7-Méthyloctanoate d'octadécyle [French] [ACD/IUPAC Name]
Octadecyl 7-methyloctanoate [ACD/IUPAC Name]
Octadecyl-7-methyloctanoat [German] [ACD/IUPAC Name]
Octanoic acid, 7-methyl-, octadecyl ester [ACD/Index Name]
84878-34-2 [RN]
Octadecyl isononanoate
Octadecylisononanoate

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

Density: 0.9±0.1 g/cm3
Boiling Point: 443.9±13.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 70.2±3.0 kJ/mol
Flash Point: 226.7±9.7 °C
Index of Refraction: 1.452
Molar Refractivity: 128.9±0.3 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 24
#Rule of 5 Violations: 1
ACD/LogP: 12.74
ACD/LogD (pH 5.5): 11.52
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 10000000.00
ACD/LogD (pH 7.4): 11.52
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 10000000.00
Polar Surface Area: 26 Å2
Polarizability: 51.1±0.5 10-24cm3
Surface Tension: 31.0±3.0 dyne/cm
Molar Volume: 478.1±3.0 cm3

Click to predict properties on the Chemicalize site


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