ChemSpider 2D Image | 4-Fluoro-7-nitro-2-(trifluoromethyl)-1H-benzimidazole | C8H3F4N3O2

4-Fluoro-7-nitro-2-(trifluoromethyl)-1H-benzimidazole

  • Molecular FormulaC8H3F4N3O2
  • Average mass249.122 Da
  • Monoisotopic mass249.016144 Da
  • ChemSpider ID28541869

More details:

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

1H-Benzimidazole, 7-fluoro-4-nitro-2-(trifluoromethyl)- [ACD/Index Name]
4-Fluor-7-nitro-2-(trifluormethyl)-1H-benzimidazol [German] [ACD/IUPAC Name]
4-Fluoro-7-nitro-2-(trifluoromethyl)-1H-benzimidazole [ACD/IUPAC Name]
4-Fluoro-7-nitro-2-(trifluorométhyl)-1H-benzimidazole [French] [ACD/IUPAC Name]
18645-98-2 [RN]
4-Fluoro-7-nitro-2-(trifluoromethyl)-1H-benzo[d]imidazole
7-fluoro-4-nitro-2-(trifluoromethyl)-1H-benzo[d]imidazole

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

Density: 1.7±0.1 g/cm3
Boiling Point: 369.6±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 59.2±3.0 kJ/mol
Flash Point: 177.3±27.9 °C
Index of Refraction: 1.580
Molar Refractivity: 48.1±0.3 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 1.68
ACD/LogD (pH 5.5): 1.89
ACD/BCF (pH 5.5): 11.41
ACD/KOC (pH 5.5): 131.23
ACD/LogD (pH 7.4): 0.66
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 7.70
Polar Surface Area: 75 Å2
Polarizability: 19.1±0.5 10-24cm3
Surface Tension: 50.0±3.0 dyne/cm
Molar Volume: 144.7±3.0 cm3

Click to predict properties on the Chemicalize site


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