ChemSpider 2D Image | 2-Nitro-6-(trifluoromethoxy)benzonitrile | C8H3F3N2O3

2-Nitro-6-(trifluoromethoxy)benzonitrile

  • Molecular FormulaC8H3F3N2O3
  • Average mass232.116 Da
  • Monoisotopic mass232.009583 Da
  • ChemSpider ID23348052

More details:

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

2-Nitro-6-(trifluormethoxy)benzonitril [German] [ACD/IUPAC Name]
2-Nitro-6-(trifluoromethoxy)benzonitrile [ACD/IUPAC Name]
2-Nitro-6-(trifluorométhoxy)benzonitrile [French] [ACD/IUPAC Name]
Benzonitrile, 2-nitro-6-(trifluoromethoxy)- [ACD/Index Name]
1214346-86-7 [RN]
MFCD09745168

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

Density: 1.5±0.1 g/cm3
Boiling Point: 317.1±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 55.8±3.0 kJ/mol
Flash Point: 145.6±27.9 °C
Index of Refraction: 1.498
Molar Refractivity: 44.1±0.4 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 2.89
ACD/LogD (pH 5.5): 2.56
ACD/BCF (pH 5.5): 52.17
ACD/KOC (pH 5.5): 590.11
ACD/LogD (pH 7.4): 2.56
ACD/BCF (pH 7.4): 52.17
ACD/KOC (pH 7.4): 590.11
Polar Surface Area: 79 Å2
Polarizability: 17.5±0.5 10-24cm3
Surface Tension: 46.3±5.0 dyne/cm
Molar Volume: 150.5±5.0 cm3

Click to predict properties on the Chemicalize site


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