ChemSpider 2D Image | (2Z)-2-(1H-Benzimidazol-2-yl)-3-[1-phenyl-3-(3-pyridinyl)-1H-pyrazol-4-yl]acrylonitrile | C24H16N6

(2Z)-2-(1H-Benzimidazol-2-yl)-3-[1-phenyl-3-(3-pyridinyl)-1H-pyrazol-4-yl]acrylonitrile

  • Molecular FormulaC24H16N6
  • Average mass388.424 Da
  • Monoisotopic mass388.143646 Da
  • ChemSpider ID30566975

  • Double-bond stereo - Double-bond stereo

More details:

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

(2Z)-2-(1H-Benzimidazol-2-yl)-3-[1-phenyl-3-(3-pyridinyl)-1H-pyrazol-4-yl]acrylonitril [German] [ACD/IUPAC Name]
(2Z)-2-(1H-Benzimidazol-2-yl)-3-[1-phenyl-3-(3-pyridinyl)-1H-pyrazol-4-yl]acrylonitrile [ACD/IUPAC Name]
(2Z)-2-(1H-Benzimidazol-2-yl)-3-[1-phényl-3-(3-pyridinyl)-1H-pyrazol-4-yl]acrylonitrile [French] [ACD/IUPAC Name]
1H-Benzimidazole-2-acetonitrile, α-[[1-phenyl-3-(3-pyridinyl)-1H-pyrazol-4-yl]methylene]-, (αZ)- [ACD/Index Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 683.1±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.1 mmHg at 25°C
Enthalpy of Vaporization: 100.2±3.0 kJ/mol
Flash Point: 366.9±34.3 °C
Index of Refraction: 1.712
Molar Refractivity: 118.5±0.5 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 4.70
ACD/LogD (pH 5.5): 3.97
ACD/BCF (pH 5.5): 598.93
ACD/KOC (pH 5.5): 3287.13
ACD/LogD (pH 7.4): 4.02
ACD/BCF (pH 7.4): 663.31
ACD/KOC (pH 7.4): 3640.47
Polar Surface Area: 83 Å2
Polarizability: 47.0±0.5 10-24cm3
Surface Tension: 55.9±7.0 dyne/cm
Molar Volume: 302.5±7.0 cm3

Click to predict properties on the Chemicalize site


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