ChemSpider 2D Image | (~2~H_3_)Methyl 8-methylnonanoate | C11H19D3O2

(2H3)Methyl 8-methylnonanoate

  • Molecular FormulaC11H19D3O2
  • Average mass189.310 Da
  • Monoisotopic mass189.180817 Da
  • ChemSpider ID58780023
  • Non-standard isotope - Non-standard isotope


More details:






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

(2H3)Methyl 8-methylnonanoate [ACD/IUPAC Name]
(2H3)Methyl-8-methylnonanoat [German] [ACD/IUPAC Name]
8-Méthylnonanoate de (2H3)méthyle [French] [ACD/IUPAC Name]
Nonanoic acid, 8-methyl-, methyl-d3 ester [ACD/Index Name]

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

Density: 0.9±0.1 g/cm3
Boiling Point: 214.2±8.0 °C at 760 mmHg
Vapour Pressure: 0.2±0.4 mmHg at 25°C
Enthalpy of Vaporization: 45.0±3.0 kJ/mol
Flash Point: 82.9±8.3 °C
Index of Refraction: 1.425
Molar Refractivity: 54.7±0.3 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 4.24
ACD/LogD (pH 5.5): 4.25
ACD/BCF (pH 5.5): 1007.03
ACD/KOC (pH 5.5): 4911.08
ACD/LogD (pH 7.4): 4.25
ACD/BCF (pH 7.4): 1007.03
ACD/KOC (pH 7.4): 4911.08
Polar Surface Area: 26 Å2
Polarizability: 21.7±0.5 10-24cm3
Surface Tension: 27.9±3.0 dyne/cm
Molar Volume: 214.0±3.0 cm3

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