ChemSpider 2D Image | Methyl (14S)-14-methylhexadecanoate | C18H36O2

Methyl (14S)-14-methylhexadecanoate

  • Molecular FormulaC18H36O2
  • Average mass284.477 Da
  • Monoisotopic mass284.271515 Da
  • ChemSpider ID114101226

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(14S)-14-Méthylhexadécanoate de méthyle [French] [ACD/IUPAC Name]
Hexadecanoic acid, 14-methyl-, methyl ester, (14S)- [ACD/Index Name]
Methyl (14S)-14-methylhexadecanoate [ACD/IUPAC Name]
Methyl-(14S)-14-methylhexadecanoat [German] [ACD/IUPAC Name]

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

Density: 0.9±0.1 g/cm3
Boiling Point: 326.5±10.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 56.9±3.0 kJ/mol
Flash Point: 153.2±8.8 °C
Index of Refraction: 1.442
Molar Refractivity: 87.2±0.3 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 15
#Rule of 5 Violations: 1
ACD/LogP: 7.96
ACD/LogD (pH 5.5): 7.14
ACD/BCF (pH 5.5): 157470.55
ACD/KOC (pH 5.5): 182697.28
ACD/LogD (pH 7.4): 7.14
ACD/BCF (pH 7.4): 157470.55
ACD/KOC (pH 7.4): 182697.28
Polar Surface Area: 26 Å2
Polarizability: 34.6±0.5 10-24cm3
Surface Tension: 29.9±3.0 dyne/cm
Molar Volume: 329.5±3.0 cm3

Click to predict properties on the Chemicalize site


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