ChemSpider 2D Image | 2-Bromo(~2~H_4_)benzonitrile | C7D4BrN

2-Bromo(2H4)benzonitrile

  • Molecular FormulaC7D4BrN
  • Average mass186.042 Da
  • Monoisotopic mass184.977814 Da
  • ChemSpider ID9655702

  • Non-standard isotope - Non-standard isotope

More details:

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

2-Brom(2H4)benzonitril [German] [ACD/IUPAC Name]
2-Bromo(2H4)benzonitrile [ACD/IUPAC Name]
2-Bromo(2H4)benzonitrile [French] [ACD/IUPAC Name]
Benzonitrile-2,3,4,5-d4, 6-bromo- [ACD/Index Name]
1-Bromo-2-cyanobenzene-3,4,5,6-d4

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

Density: 1.6±0.1 g/cm3
Boiling Point: 252.0±0.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.5 mmHg at 25°C
Enthalpy of Vaporization: 48.9±3.0 kJ/mol
Flash Point: 113.7±22.6 °C
Index of Refraction: 1.606
Molar Refractivity: 39.0±0.4 cm3
#H bond acceptors: 1
#H bond donors: 0
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 2.23
ACD/LogD (pH 5.5): 2.45
ACD/BCF (pH 5.5): 42.73
ACD/KOC (pH 5.5): 511.59
ACD/LogD (pH 7.4): 2.45
ACD/BCF (pH 7.4): 42.73
ACD/KOC (pH 7.4): 511.59
Polar Surface Area: 24 Å2
Polarizability: 15.5±0.5 10-24cm3
Surface Tension: 52.2±5.0 dyne/cm
Molar Volume: 113.1±5.0 cm3

Click to predict properties on the Chemicalize site


Advertisement