ChemSpider 2D Image | tert-butyl 4-phenyl-1,2,3,6-tetrahydropyridine-1-carboxylate | C16H21NO2

tert-butyl 4-phenyl-1,2,3,6-tetrahydropyridine-1-carboxylate

  • Molecular FormulaC16H21NO2
  • Average mass259.343 Da
  • Monoisotopic mass259.157227 Da
  • ChemSpider ID19062773

More details:

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

1(2H)-Pyridinecarboxylic acid, 3,6-dihydro-4-phenyl-, 1,1-dimethylethyl ester [ACD/Index Name]
186347-72-8 [RN]
2-Methyl-2-propanyl 4-phenyl-3,6-dihydro-1(2H)-pyridinecarboxylate [ACD/IUPAC Name]
2-Methyl-2-propanyl-4-phenyl-3,6-dihydro-1(2H)-pyridincarboxylat [German] [ACD/IUPAC Name]
4-Phényl-3,6-dihydro-1(2H)-pyridinecarboxylate de 2-méthyl-2-propanyle [French] [ACD/IUPAC Name]
tert-butyl 4-phenyl-1,2,3,6-tetrahydropyridine-1-carboxylate
[186347-72-8] [RN]
1(2H)-Pyridinecarboxylic acid, 3,6-dihydro-4-phenyl-, 1,1-dimethylethylester
MFCD11977149 [MDL number]
t-Butyl 4-phenyl-5,6-dihydropyridine-1(2H)-carboxylate
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.1±0.1 g/cm3
    Boiling Point: 362.4±42.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.8 mmHg at 25°C
    Enthalpy of Vaporization: 60.8±3.0 kJ/mol
    Flash Point: 173.0±27.9 °C
    Index of Refraction: 1.541
    Molar Refractivity: 75.5±0.3 cm3
    #H bond acceptors: 3
    #H bond donors: 0
    #Freely Rotating Bonds: 3
    #Rule of 5 Violations: 0
    ACD/LogP: 3.47
    ACD/LogD (pH 5.5): 3.59
    ACD/BCF (pH 5.5): 313.52
    ACD/KOC (pH 5.5): 2130.27
    ACD/LogD (pH 7.4): 3.59
    ACD/BCF (pH 7.4): 313.52
    ACD/KOC (pH 7.4): 2130.27
    Polar Surface Area: 30 Å2
    Polarizability: 29.9±0.5 10-24cm3
    Surface Tension: 40.8±3.0 dyne/cm
    Molar Volume: 240.2±3.0 cm3

    Click to predict properties on the Chemicalize site


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