ChemSpider 2D Image | 2-Methyl-2-propanyl 5-fluoro-4-phenyl-3,6-dihydro-1(2H)-pyridinecarboxylate | C16H20FNO2

2-Methyl-2-propanyl 5-fluoro-4-phenyl-3,6-dihydro-1(2H)-pyridinecarboxylate

  • Molecular FormulaC16H20FNO2
  • Average mass277.334 Da
  • Monoisotopic mass277.147797 Da
  • ChemSpider ID34983043

More details:

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

1(2H)-Pyridinecarboxylic acid, 3-fluoro-5,6-dihydro-4-phenyl-, 1,1-dimethylethyl ester [ACD/Index Name]
2-Methyl-2-propanyl 5-fluoro-4-phenyl-3,6-dihydro-1(2H)-pyridinecarboxylate [ACD/IUPAC Name]
2-Methyl-2-propanyl-5-fluor-4-phenyl-3,6-dihydro-1(2H)-pyridincarboxylat [German] [ACD/IUPAC Name]
5-Fluoro-4-phényl-3,6-dihydro-1(2H)-pyridinecarboxylate de 2-méthyl-2-propanyle [French] [ACD/IUPAC Name]
651321-26-5 [RN]
MFCD21601866
tert-butyl 3-fluoro-4-phenyl-5,6-dihydro-2H-pyridine-1-carboxylate
tert-butyl 3-Fluoro-4-phenyl-5,6-dihydropyridine-1(2H)-carboxylate
tert-butyl 5-fluoro-4-phenyl-1,2,3,6-tetrahydropyridine-1-carboxylate
tert-butyl 5-fluoro-4-phenyl-3,6-dihydropyridine-1(2H)-carboxylate

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

    Density: 1.1±0.1 g/cm3
    Boiling Point: 368.8±42.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.8 mmHg at 25°C
    Enthalpy of Vaporization: 61.6±3.0 kJ/mol
    Flash Point: 176.9±27.9 °C
    Index of Refraction: 1.539
    Molar Refractivity: 76.3±0.4 cm3
    #H bond acceptors: 3
    #H bond donors: 0
    #Freely Rotating Bonds: 3
    #Rule of 5 Violations: 0
    ACD/LogP: 4.04
    ACD/LogD (pH 5.5): 3.89
    ACD/BCF (pH 5.5): 533.87
    ACD/KOC (pH 5.5): 3118.17
    ACD/LogD (pH 7.4): 3.89
    ACD/BCF (pH 7.4): 533.87
    ACD/KOC (pH 7.4): 3118.17
    Polar Surface Area: 30 Å2
    Polarizability: 30.3±0.5 10-24cm3
    Surface Tension: 39.9±5.0 dyne/cm
    Molar Volume: 243.6±5.0 cm3

    Click to predict properties on the Chemicalize site


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