ChemSpider 2D Image | 2-(~2~H_5_)Phenylpropanenitrile | C9H4D5N

2-(2H5)Phenylpropanenitrile

  • Molecular FormulaC9H4D5N
  • Average mass136.205 Da
  • Monoisotopic mass136.104889 Da
  • ChemSpider ID48062441

  • Non-standard isotope - Non-standard isotope

More details:

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

2-(2H5)Phenylpropanenitrile [ACD/IUPAC Name]
2-(2H5)Phénylpropanenitrile [French] [ACD/IUPAC Name]
2-(2H5)Phenylpropannitril [German] [ACD/IUPAC Name]
Benzene-2,3,4,5,6-d5-acetonitrile, α-methyl- [ACD/Index Name]
1330238-27-1 [RN]
2-(2,3,4,5,6-pentadeuteriophenyl)propanenitrile

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

Density: 1.0±0.1 g/cm3
Boiling Point: 231.0±0.0 °C at 760 mmHg
Vapour Pressure: 0.1±0.4 mmHg at 25°C
Enthalpy of Vaporization: 46.8±3.0 kJ/mol
Flash Point: 93.9±0.0 °C
Index of Refraction: 1.519
Molar Refractivity: 40.4±0.3 cm3
#H bond acceptors: 1
#H bond donors: 0
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 1.80
ACD/LogD (pH 5.5): 1.82
ACD/BCF (pH 5.5): 14.24
ACD/KOC (pH 5.5): 232.95
ACD/LogD (pH 7.4): 1.82
ACD/BCF (pH 7.4): 14.24
ACD/KOC (pH 7.4): 232.95
Polar Surface Area: 24 Å2
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


Advertisement