ChemSpider 2D Image | Ethyl 6-oxo-5-phenyl-2-(trifluoromethyl)-1,6-dihydro-3-pyridinecarboxylate | C15H12F3NO3

Ethyl 6-oxo-5-phenyl-2-(trifluoromethyl)-1,6-dihydro-3-pyridinecarboxylate

  • Molecular FormulaC15H12F3NO3
  • Average mass311.256 Da
  • Monoisotopic mass311.076935 Da
  • ChemSpider ID30653219

More details:

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

3-Pyridinecarboxylic acid, 1,6-dihydro-6-oxo-5-phenyl-2-(trifluoromethyl)-, ethyl ester [ACD/Index Name]
6-Oxo-5-phényl-2-(trifluorométhyl)-1,6-dihydro-3-pyridinecarboxylate d'éthyle [French] [ACD/IUPAC Name]
Ethyl 6-oxo-5-phenyl-2-(trifluoromethyl)-1,6-dihydro-3-pyridinecarboxylate [ACD/IUPAC Name]
Ethyl-6-oxo-5-phenyl-2-(trifluormethyl)-1,6-dihydro-3-pyridincarboxylat [German] [ACD/IUPAC Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 422.0±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 67.6±3.0 kJ/mol
Flash Point: 209.0±28.7 °C
Index of Refraction: 1.523
Molar Refractivity: 70.5±0.3 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 2.49
ACD/LogD (pH 5.5): 2.05
ACD/BCF (pH 5.5): 19.46
ACD/KOC (pH 5.5): 264.53
ACD/LogD (pH 7.4): 0.79
ACD/BCF (pH 7.4): 1.08
ACD/KOC (pH 7.4): 14.65
Polar Surface Area: 55 Å2
Polarizability: 28.0±0.5 10-24cm3
Surface Tension: 40.2±3.0 dyne/cm
Molar Volume: 230.9±3.0 cm3

Click to predict properties on the Chemicalize site


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