ChemSpider 2D Image | 4-{[(4-Bromo-3-chlorophenyl)imino]methyl}benzonitrile | C14H8BrClN2

4-{[(4-Bromo-3-chlorophenyl)imino]methyl}benzonitrile

  • Molecular FormulaC14H8BrClN2
  • Average mass319.584 Da
  • Monoisotopic mass317.955933 Da
  • ChemSpider ID32782473

More details:

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

4-{[(4-Brom-3-chlorphenyl)imino]methyl}benzonitril [German] [ACD/IUPAC Name]
4-{[(4-Bromo-3-chlorophenyl)imino]methyl}benzonitrile [ACD/IUPAC Name]
4-{[(4-Bromo-3-chlorophényl)imino]méthyl}benzonitrile [French] [ACD/IUPAC Name]
Benzonitrile, 4-[[(4-bromo-3-chlorophenyl)imino]methyl]- [ACD/Index Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 473.0±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 73.6±3.0 kJ/mol
Flash Point: 239.9±28.7 °C
Index of Refraction: 1.623
Molar Refractivity: 79.1±0.5 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 4.20
ACD/LogD (pH 5.5): 4.65
ACD/BCF (pH 5.5): 2009.22
ACD/KOC (pH 5.5): 8051.96
ACD/LogD (pH 7.4): 4.65
ACD/BCF (pH 7.4): 2009.25
ACD/KOC (pH 7.4): 8052.10
Polar Surface Area: 36 Å2
Polarizability: 31.4±0.5 10-24cm3
Surface Tension: 46.1±7.0 dyne/cm
Molar Volume: 224.3±7.0 cm3

Click to predict properties on the Chemicalize site


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