ChemSpider 2D Image | 4-Cyano-5-fluoro-6-(trifluoromethoxy)nicotinamide | C8H3F4N3O2

4-Cyano-5-fluoro-6-(trifluoromethoxy)nicotinamide

  • Molecular FormulaC8H3F4N3O2
  • Average mass249.122 Da
  • Monoisotopic mass249.016144 Da
  • ChemSpider ID57335769

More details:

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

3-Pyridinecarboxamide, 4-cyano-5-fluoro-6-(trifluoromethoxy)- [ACD/Index Name]
4-Cyan-5-fluor-6-(trifluormethoxy)nicotinamid [German] [ACD/IUPAC Name]
4-Cyano-5-fluoro-6-(trifluoromethoxy)nicotinamide [ACD/IUPAC Name]
4-Cyano-5-fluoro-6-(trifluorométhoxy)nicotinamide [French] [ACD/IUPAC Name]
1806248-89-4 [RN]
4-Cyano-3-fluoro-2-(trifluoromethoxy)pyridine-5-carboxamide

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

Density: 1.6±0.1 g/cm3
Boiling Point: 231.7±40.0 °C at 760 mmHg
Vapour Pressure: 0.1±0.5 mmHg at 25°C
Enthalpy of Vaporization: 46.8±3.0 kJ/mol
Flash Point: 93.9±27.3 °C
Index of Refraction: 1.491
Molar Refractivity: 44.3±0.4 cm3
#H bond acceptors: 5
#H bond donors: 2
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 0.97
ACD/LogD (pH 5.5): 0.52
ACD/BCF (pH 5.5): 1.47
ACD/KOC (pH 5.5): 45.87
ACD/LogD (pH 7.4): 0.52
ACD/BCF (pH 7.4): 1.47
ACD/KOC (pH 7.4): 45.87
Polar Surface Area: 89 Å2
Polarizability: 17.6±0.5 10-24cm3
Surface Tension: 52.3±5.0 dyne/cm
Molar Volume: 153.0±5.0 cm3

Click to predict properties on the Chemicalize site


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