ChemSpider 2D Image | 2-Chlorobenzyl cyanide | C8H6ClN

2-Chlorobenzyl cyanide

  • Molecular FormulaC8H6ClN
  • Average mass151.593 Da
  • Monoisotopic mass151.018875 Da
  • ChemSpider ID21111776

More details:

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

(2-Chlorophenyl)acetonitrile [ACD/IUPAC Name]
(2-Chlorophényl)acétonitrile [French] [ACD/IUPAC Name]
(2-Chlorphenyl)acetonitril [German] [ACD/IUPAC Name]
220-669-4 [EINECS]
2856-63-5 [RN]
2-Chlorobenzyl cyanide
2-chlorophenylacetonitrile
Benzeneacetonitrile, 2-chloro- [ACD/Index Name]
(2-Chloro-phenyl)-acetonitrile
(2-chlorophenyl)acetonitrile|benzeneacetonitrile, 2-chloro-
More...

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

MFCD00001898 [DBID]
188492_ALDRICH [DBID]
CCRIS 4693 [DBID]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 254.0±15.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.5 mmHg at 25°C
Enthalpy of Vaporization: 49.1±3.0 kJ/mol
Flash Point: 107.7±15.4 °C
Index of Refraction: 1.549
Molar Refractivity: 40.6±0.3 cm3
#H bond acceptors: 1
#H bond donors: 0
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 2.04
ACD/LogD (pH 5.5): 2.11
ACD/BCF (pH 5.5): 23.46
ACD/KOC (pH 5.5): 333.06
ACD/LogD (pH 7.4): 2.11
ACD/BCF (pH 7.4): 23.46
ACD/KOC (pH 7.4): 333.06
Polar Surface Area: 24 Å2
Polarizability: 16.1±0.5 10-24cm3
Surface Tension: 43.7±3.0 dyne/cm
Molar Volume: 127.6±3.0 cm3

Click to predict properties on the Chemicalize site


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