ChemSpider 2D Image | 4-{[3-(Trifluoromethyl)phenyl]amino}nicotinate | C13H8F3N2O2

4-{[3-(Trifluoromethyl)phenyl]amino}nicotinate

  • Molecular FormulaC13H8F3N2O2
  • Average mass281.211 Da
  • Monoisotopic mass281.054321 Da
  • ChemSpider ID95717782

  • Charge - Charge

More details:

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

3-Pyridinecarboxylic acid, 4-[[3-(trifluoromethyl)phenyl]amino]-, ion(1-) [ACD/Index Name]
4-{[3-(Trifluormethyl)phenyl]amino}nicotinat [German] [ACD/IUPAC Name]
4-{[3-(Trifluoromethyl)phenyl]amino}nicotinate [ACD/IUPAC Name]
4-{[3-(Trifluorométhyl)phényl]amino}nicotinate [French] [ACD/IUPAC Name]

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

Density:
Boiling Point: 396.4±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 68.2±3.0 kJ/mol
Flash Point: 193.6±27.9 °C
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 4
#H bond donors: 2
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 4.85
ACD/LogD (pH 5.5): 2.15
ACD/BCF (pH 5.5): 7.01
ACD/KOC (pH 5.5): 30.87
ACD/LogD (pH 7.4): 1.37
ACD/BCF (pH 7.4): 1.18
ACD/KOC (pH 7.4): 5.18
Polar Surface Area: 65 Å2
Polarizability:
Surface Tension:
Molar Volume:

Click to predict properties on the Chemicalize site


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