ChemSpider 2D Image | Methyl 6-oxo-1-{2-oxo-2-[(2,2,2-trifluoroethyl)amino]ethyl}-1,6-dihydro-3-pyridinecarboxylate | C11H11F3N2O4

Methyl 6-oxo-1-{2-oxo-2-[(2,2,2-trifluoroethyl)amino]ethyl}-1,6-dihydro-3-pyridinecarboxylate

  • Molecular FormulaC11H11F3N2O4
  • Average mass292.211 Da
  • Monoisotopic mass292.067078 Da
  • ChemSpider ID22103516

More details:

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

3-Pyridinecarboxylic acid, 1,6-dihydro-6-oxo-1-[2-oxo-2-[(2,2,2-trifluoroethyl)amino]ethyl]-, methyl ester [ACD/Index Name]
6-Oxo-1-{2-oxo-2-[(2,2,2-trifluoroéthyl)amino]éthyl}-1,6-dihydro-3-pyridinecarboxylate de méthyle [French] [ACD/IUPAC Name]
Methyl 6-oxo-1-{2-oxo-2-[(2,2,2-trifluoroethyl)amino]ethyl}-1,6-dihydro-3-pyridinecarboxylate [ACD/IUPAC Name]
Methyl-6-oxo-1-{2-oxo-2-[(2,2,2-trifluorethyl)amino]ethyl}-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: 1.4±0.1 g/cm3
Boiling Point: 466.4±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 72.8±3.0 kJ/mol
Flash Point: 235.9±28.7 °C
Index of Refraction: 1.482
Molar Refractivity: 59.6±0.3 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: -0.34
ACD/LogD (pH 5.5): -0.21
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 18.27
ACD/LogD (pH 7.4): -0.21
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 18.27
Polar Surface Area: 76 Å2
Polarizability: 23.6±0.5 10-24cm3
Surface Tension: 40.2±3.0 dyne/cm
Molar Volume: 209.1±3.0 cm3

Click to predict properties on the Chemicalize site


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