ChemSpider 2D Image | 6-Cyano-N-(2,3,4-trifluorophenyl)nicotinamide | C13H6F3N3O

6-Cyano-N-(2,3,4-trifluorophenyl)nicotinamide

  • Molecular FormulaC13H6F3N3O
  • Average mass277.201 Da
  • Monoisotopic mass277.046295 Da
  • ChemSpider ID32217026

More details:

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

3-Pyridinecarboxamide, 6-cyano-N-(2,3,4-trifluorophenyl)- [ACD/Index Name]
6-Cyan-N-(2,3,4-trifluorphenyl)nicotinamid [German] [ACD/IUPAC Name]
6-Cyano-N-(2,3,4-trifluorophenyl)nicotinamide [ACD/IUPAC Name]
6-Cyano-N-(2,3,4-trifluorophényl)nicotinamide [French] [ACD/IUPAC Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 334.3±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 57.7±3.0 kJ/mol
Flash Point: 156.0±27.9 °C
Index of Refraction: 1.579
Molar Refractivity: 62.6±0.4 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 2.49
ACD/LogD (pH 5.5): 1.70
ACD/BCF (pH 5.5): 11.42
ACD/KOC (pH 5.5): 198.92
ACD/LogD (pH 7.4): 1.67
ACD/BCF (pH 7.4): 10.78
ACD/KOC (pH 7.4): 187.80
Polar Surface Area: 66 Å2
Polarizability: 24.8±0.5 10-24cm3
Surface Tension: 56.7±5.0 dyne/cm
Molar Volume: 188.1±5.0 cm3

Click to predict properties on the Chemicalize site


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