ChemSpider 2D Image | N-(3-Cyano-4-fluorophenyl)-2,3-difluoroisonicotinamide | C13H6F3N3O

N-(3-Cyano-4-fluorophenyl)-2,3-difluoroisonicotinamide

  • Molecular FormulaC13H6F3N3O
  • Average mass277.201 Da
  • Monoisotopic mass277.046295 Da
  • ChemSpider ID51386318

More details:

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

4-Pyridinecarboxamide, N-(3-cyano-4-fluorophenyl)-2,3-difluoro- [ACD/Index Name]
N-(3-Cyan-4-fluorphenyl)-2,3-difluorisonicotinamid [German] [ACD/IUPAC Name]
N-(3-Cyano-4-fluorophenyl)-2,3-difluoroisonicotinamide [ACD/IUPAC Name]
N-(3-Cyano-4-fluorophényl)-2,3-difluoroisonicotinamide [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: 329.9±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 57.2±3.0 kJ/mol
Flash Point: 153.3±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: 1.55
ACD/LogD (pH 5.5): 1.51
ACD/BCF (pH 5.5): 8.26
ACD/KOC (pH 5.5): 157.63
ACD/LogD (pH 7.4): 1.41
ACD/BCF (pH 7.4): 6.55
ACD/KOC (pH 7.4): 125.06
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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