ChemSpider 2D Image | (2E)-1H-Benzimidazol-2-yl(1-methyl-2-oxo-1,2-dihydro-3H-indol-3-ylidene)acetonitrile | C18H12N4O

(2E)-1H-Benzimidazol-2-yl(1-methyl-2-oxo-1,2-dihydro-3H-indol-3-ylidene)acetonitrile

  • Molecular FormulaC18H12N4O
  • Average mass300.314 Da
  • Monoisotopic mass300.101105 Da
  • ChemSpider ID110407269

  • Double-bond stereo - Double-bond stereo

More details:

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

(2E)-1H-Benzimidazol-2-yl(1-methyl-2-oxo-1,2-dihydro-3H-indol-3-yliden)acetonitril [German] [ACD/IUPAC Name]
(2E)-1H-Benzimidazol-2-yl(1-methyl-2-oxo-1,2-dihydro-3H-indol-3-ylidene)acetonitrile [ACD/IUPAC Name]
(2E)-1H-Benzimidazol-2-yl(1-méthyl-2-oxo-1,2-dihydro-3H-indol-3-ylidène)acétonitrile [French] [ACD/IUPAC Name]
1H-Benzimidazole-2-acetonitrile, α-(1,2-dihydro-1-methyl-2-oxo-3H-indol-3-ylidene)-, (αE)- [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: 506.5±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 77.6±3.0 kJ/mol
Flash Point: 260.1±32.9 °C
Index of Refraction: 1.747
Molar Refractivity: 86.4±0.3 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 2.08
ACD/LogD (pH 5.5): 2.26
ACD/BCF (pH 5.5): 30.33
ACD/KOC (pH 5.5): 391.00
ACD/LogD (pH 7.4): 2.30
ACD/BCF (pH 7.4): 32.87
ACD/KOC (pH 7.4): 423.81
Polar Surface Area: 73 Å2
Polarizability: 34.3±0.5 10-24cm3
Surface Tension: 76.5±3.0 dyne/cm
Molar Volume: 212.8±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement