ChemSpider 2D Image | 1-(3-Bromophenyl)cyclohexanecarbonitrile | C13H14BrN

1-(3-Bromophenyl)cyclohexanecarbonitrile

  • Molecular FormulaC13H14BrN
  • Average mass264.161 Da
  • Monoisotopic mass263.030945 Da
  • ChemSpider ID30911379

More details:

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

1-(3-Bromophenyl)cyclohexanecarbonitrile [ACD/IUPAC Name]
1-(3-Bromophényl)cyclohexanecarbonitrile [French] [ACD/IUPAC Name]
1-(3-Bromphenyl)cyclohexancarbonitril [German] [ACD/IUPAC Name]
Cyclohexanecarbonitrile, 1-(3-bromophenyl)- [ACD/Index Name]
1-(3-bromophenyl)cyclohexane-1-carbonitrile
676138-32-2 [RN]
CYCLOHEXANECARBONITRILE,1-(3-BROMOPHENYL)-
MFCD11036802

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

Density: 1.4±0.1 g/cm3
Boiling Point: 376.9±35.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 62.5±3.0 kJ/mol
Flash Point: 181.7±25.9 °C
Index of Refraction: 1.584
Molar Refractivity: 64.8±0.4 cm3
#H bond acceptors: 1
#H bond donors: 0
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 4.00
ACD/LogD (pH 5.5): 4.21
ACD/BCF (pH 5.5): 935.32
ACD/KOC (pH 5.5): 4658.14
ACD/LogD (pH 7.4): 4.21
ACD/BCF (pH 7.4): 935.32
ACD/KOC (pH 7.4): 4658.14
Polar Surface Area: 24 Å2
Polarizability: 25.7±0.5 10-24cm3
Surface Tension: 48.7±5.0 dyne/cm
Molar Volume: 193.5±5.0 cm3

Click to predict properties on the Chemicalize site


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