ChemSpider 2D Image | (2Z)-3-(2,6-Dichlorophenyl)-2-(5,6-dimethyl-1H-benzimidazol-2-yl)acrylonitrile | C18H13Cl2N3

(2Z)-3-(2,6-Dichlorophenyl)-2-(5,6-dimethyl-1H-benzimidazol-2-yl)acrylonitrile

  • Molecular FormulaC18H13Cl2N3
  • Average mass342.222 Da
  • Monoisotopic mass341.048645 Da
  • ChemSpider ID32232905

  • Double-bond stereo - Double-bond stereo

More details:

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

(2Z)-3-(2,6-Dichlorophenyl)-2-(5,6-dimethyl-1H-benzimidazol-2-yl)acrylonitrile [ACD/IUPAC Name]
(2Z)-3-(2,6-Dichlorophényl)-2-(5,6-diméthyl-1H-benzimidazol-2-yl)acrylonitrile [French] [ACD/IUPAC Name]
(2Z)-3-(2,6-Dichlorphenyl)-2-(5,6-dimethyl-1H-benzimidazol-2-yl)acrylonitril [German] [ACD/IUPAC Name]
1H-Benzimidazole-2-acetonitrile, α-[(2,6-dichlorophenyl)methylene]-5,6-dimethyl-, (αZ)- [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: 556.1±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 83.8±3.0 kJ/mol
Flash Point: 290.1±32.9 °C
Index of Refraction: 1.707
Molar Refractivity: 96.6±0.3 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 1
ACD/LogP: 5.65
ACD/LogD (pH 5.5): 5.59
ACD/BCF (pH 5.5): 9895.86
ACD/KOC (pH 5.5): 23914.26
ACD/LogD (pH 7.4): 5.66
ACD/BCF (pH 7.4): 11869.59
ACD/KOC (pH 7.4): 28683.97
Polar Surface Area: 52 Å2
Polarizability: 38.3±0.5 10-24cm3
Surface Tension: 61.7±3.0 dyne/cm
Molar Volume: 248.0±3.0 cm3

Click to predict properties on the Chemicalize site


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