ChemSpider 2D Image | (~2~H_3_)Methyl tridecanoate | C14H25D3O2

(2H3)Methyl tridecanoate

  • Molecular FormulaC14H25D3O2
  • Average mass231.389 Da
  • Monoisotopic mass231.227753 Da
  • ChemSpider ID58780143

  • Non-standard isotope - Non-standard isotope

More details:

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

(2H3)Methyl tridecanoate [ACD/IUPAC Name]
(2H3)Methyl-tridecanoat [German] [ACD/IUPAC Name]
Tridécanoate de (2H3)méthyle [French] [ACD/IUPAC Name]
Tridecanoic acid, methyl-d3 ester [ACD/Index 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: 289.6±0.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 52.9±3.0 kJ/mol
Flash Point: 124.9±6.9 °C
Index of Refraction: 1.435
Molar Refractivity: 68.7±0.3 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 12
#Rule of 5 Violations: 1
ACD/LogP: 6.02
ACD/LogD (pH 5.5): 5.83
ACD/BCF (pH 5.5): 15861.30
ACD/KOC (pH 5.5): 35333.78
ACD/LogD (pH 7.4): 5.83
ACD/BCF (pH 7.4): 15861.30
ACD/KOC (pH 7.4): 35333.78
Polar Surface Area: 26 Å2
Polarizability: 27.2±0.5 10-24cm3
Surface Tension: 29.6±3.0 dyne/cm
Molar Volume: 263.1±3.0 cm3

Click to predict properties on the Chemicalize site


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