ChemSpider 2D Image | Methyl (~2~H_23_)dodecanoate | C13H3D23O2

Methyl (2H23)dodecanoate

  • Molecular FormulaC13H3D23O2
  • Average mass237.486 Da
  • Monoisotopic mass237.337646 Da
  • ChemSpider ID24533208

  • Non-standard isotope - Non-standard isotope

More details:

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

(2H23)Dodécanoate de méthyle [French] [ACD/IUPAC Name]
Dodecanoic-d23 acid, methyl ester [ACD/Index Name]
Methyl (2H23)dodecanoate [ACD/IUPAC Name]
Methyl-(2H23)dodecanoat [German] [ACD/IUPAC Name]
1219804-72-4 [RN]
Methyl Dodecanoate-d23

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

Density: 0.9±0.1 g/cm3
Boiling Point: 263.0±3.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.5 mmHg at 25°C
Enthalpy of Vaporization: 50.1±3.0 kJ/mol
Flash Point: 114.6±6.9 °C
Index of Refraction: 1.433
Molar Refractivity: 64.1±0.3 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 1
ACD/LogP: 5.49
ACD/LogD (pH 5.5): 5.45
ACD/BCF (pH 5.5): 8203.53
ACD/KOC (pH 5.5): 22041.04
ACD/LogD (pH 7.4): 5.45
ACD/BCF (pH 7.4): 8203.53
ACD/KOC (pH 7.4): 22041.04
Polar Surface Area: 26 Å2
Polarizability: 25.4±0.5 10-24cm3
Surface Tension: 29.4±3.0 dyne/cm
Molar Volume: 246.6±3.0 cm3

Click to predict properties on the Chemicalize site


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