ChemSpider 2D Image | 2-Phenyl(3-~13~C,3-~2~H_1_)propanenitrile | C813CH8DN

2-Phenyl(3-13C,3-2H1)propanenitrile

  • Molecular FormulaC813CH8DN
  • Average mass133.173 Da
  • Monoisotopic mass133.083130 Da
  • ChemSpider ID77360546

  • Non-standard isotope - Non-standard isotope

More details:

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

2-Phenyl(3-13C,3-2H1)propanenitrile [ACD/IUPAC Name]
2-Phényl(3-13C,3-2H1)propanenitrile [French] [ACD/IUPAC Name]
2-Phenyl(3-13C,3-2H1)propannitril [German] [ACD/IUPAC Name]
Benzeneacetonitrile, α-(methyl-13C-d)- [ACD/Index Name]
2-Phenylpropanenitrile-3-13C-3-d

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

Density: 1.0±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.519
Molar Refractivity: 40.4±0.3 cm3
#H bond acceptors:
#H bond donors:
#Freely Rotating Bonds:
#Rule of 5 Violations:
ACD/LogP:
ACD/LogD (pH 5.5):
ACD/BCF (pH 5.5):
ACD/KOC (pH 5.5):
ACD/LogD (pH 7.4):
ACD/BCF (pH 7.4):
ACD/KOC (pH 7.4):
Polar Surface Area:
Polarizability: 16.0±0.5 10-24cm3
Surface Tension: 38.3±3.0 dyne/cm
Molar Volume: 132.9±3.0 cm3

Click to predict properties on the Chemicalize site


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