ChemSpider 2D Image | tert-butyl 4-cyano-4-(pyridin-2-yl)piperidine-1-carboxylate | C16H21N3O2

tert-butyl 4-cyano-4-(pyridin-2-yl)piperidine-1-carboxylate

  • Molecular FormulaC16H21N3O2
  • Average mass287.357 Da
  • Monoisotopic mass287.163391 Da
  • ChemSpider ID25070340

More details:

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

167263-04-9 [RN]
1-Piperidinecarboxylic acid, 4-cyano-4-(2-pyridinyl)-, 1,1-dimethylethyl ester [ACD/Index Name]
2-Methyl-2-propanyl 4-cyano-4-(2-pyridinyl)-1-piperidinecarboxylate [ACD/IUPAC Name]
2-Methyl-2-propanyl-4-cyan-4-(2-pyridinyl)-1-piperidincarboxylat [German] [ACD/IUPAC Name]
4-Cyano-4-(2-pyridinyl)-1-pipéridinecarboxylate de 2-méthyl-2-propanyle [French] [ACD/IUPAC Name]
tert-butyl 4-cyano-4-(pyridin-2-yl)piperidine-1-carboxylate
1-Boc-4-(2-pyridyl)piperidine-4-carbonitrile
1-Boc-4-cyano-4-(2-pyridinyl)-piperidine
Benzyl (2-((2-amino-4-methoxyphenyl)(phenyl)amino)-2-oxoethyl)carbamate
benzyl 2-((2-amino-4-methoxyphenyl)(phenyl)amino)-2-oxoethylcarbamate
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.2±0.1 g/cm3
    Boiling Point: 444.6±45.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.1 mmHg at 25°C
    Enthalpy of Vaporization: 70.2±3.0 kJ/mol
    Flash Point: 222.7±28.7 °C
    Index of Refraction: 1.549
    Molar Refractivity: 79.1±0.4 cm3
    #H bond acceptors: 5
    #H bond donors: 0
    #Freely Rotating Bonds: 4
    #Rule of 5 Violations: 0
    ACD/LogP: 1.20
    ACD/LogD (pH 5.5): 1.99
    ACD/BCF (pH 5.5): 16.38
    ACD/KOC (pH 5.5): 216.15
    ACD/LogD (pH 7.4): 2.25
    ACD/BCF (pH 7.4): 30.03
    ACD/KOC (pH 7.4): 396.20
    Polar Surface Area: 66 Å2
    Polarizability: 31.4±0.5 10-24cm3
    Surface Tension: 50.8±5.0 dyne/cm
    Molar Volume: 248.7±5.0 cm3

    Click to predict properties on the Chemicalize site


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