ChemSpider 2D Image | (2Z)-2-(1H-Benzimidazol-2-yl)-3-hydroxy-3-(5-nitro-2-furyl)acrylonitrile | C14H8N4O4

(2Z)-2-(1H-Benzimidazol-2-yl)-3-hydroxy-3-(5-nitro-2-furyl)acrylonitrile

  • Molecular FormulaC14H8N4O4
  • Average mass296.238 Da
  • Monoisotopic mass296.054565 Da
  • ChemSpider ID25024125

  • 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-hydroxy-3-(5-nitro-2-furyl)acrylonitril [German] [ACD/IUPAC Name]
(2Z)-2-(1H-Benzimidazol-2-yl)-3-hydroxy-3-(5-nitro-2-furyl)acrylonitrile [ACD/IUPAC Name]
(2Z)-2-(1H-Benzimidazol-2-yl)-3-hydroxy-3-(5-nitro-2-furyl)acrylonitrile [French] [ACD/IUPAC Name]
1H-Benzimidazole-2-acetonitrile, α-[hydroxy(5-nitro-2-furanyl)methylene]-, (αZ)- [ACD/Index Name]

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

Density: 1.6±0.1 g/cm3
Boiling Point: 543.3±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 86.5±3.0 kJ/mol
Flash Point: 282.4±32.9 °C
Index of Refraction: 1.750
Molar Refractivity: 76.2±0.3 cm3
#H bond acceptors: 8
#H bond donors: 2
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 2.13
ACD/LogD (pH 5.5): 0.97
ACD/BCF (pH 5.5): 2.04
ACD/KOC (pH 5.5): 34.03
ACD/LogD (pH 7.4): -0.54
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.07
Polar Surface Area: 132 Å2
Polarizability: 30.2±0.5 10-24cm3
Surface Tension: 89.0±3.0 dyne/cm
Molar Volume: 187.1±3.0 cm3

Click to predict properties on the Chemicalize site


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