ChemSpider 2D Image | N-(2-Cyanoethyl)-N-(2,2,2-trifluoroethyl)-6-(trifluoromethyl)nicotinamide | C12H9F6N3O

N-(2-Cyanoethyl)-N-(2,2,2-trifluoroethyl)-6-(trifluoromethyl)nicotinamide

  • Molecular FormulaC12H9F6N3O
  • Average mass325.210 Da
  • Monoisotopic mass325.064972 Da
  • ChemSpider ID65077553

More details:

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

3-Pyridinecarboxamide, N-(2-cyanoethyl)-N-(2,2,2-trifluoroethyl)-6-(trifluoromethyl)- [ACD/Index Name]
N-(2-Cyanethyl)-N-(2,2,2-trifluorethyl)-6-(trifluormethyl)nicotinamid [German] [ACD/IUPAC Name]
N-(2-Cyanoethyl)-N-(2,2,2-trifluoroethyl)-6-(trifluoromethyl)nicotinamide [ACD/IUPAC Name]
N-(2-Cyanoéthyl)-N-(2,2,2-trifluoroéthyl)-6-(trifluorométhyl)nicotinamide [French] [ACD/IUPAC Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 393.2±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 64.3±3.0 kJ/mol
Flash Point: 191.6±27.9 °C
Index of Refraction: 1.450
Molar Refractivity: 62.0±0.3 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 1.58
ACD/LogD (pH 5.5): 1.45
ACD/BCF (pH 5.5): 7.41
ACD/KOC (pH 5.5): 145.89
ACD/LogD (pH 7.4): 1.45
ACD/BCF (pH 7.4): 7.41
ACD/KOC (pH 7.4): 145.89
Polar Surface Area: 57 Å2
Polarizability: 24.6±0.5 10-24cm3
Surface Tension: 34.8±3.0 dyne/cm
Molar Volume: 230.8±3.0 cm3

Click to predict properties on the Chemicalize site


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