ChemSpider 2D Image | tert-Butyl 4-((3-cyanopyridin-2-yl)oxy)piperidine-1-carboxylate | C16H21N3O3

tert-Butyl 4-((3-cyanopyridin-2-yl)oxy)piperidine-1-carboxylate

  • Molecular FormulaC16H21N3O3
  • Average mass303.356 Da
  • Monoisotopic mass303.158295 Da
  • ChemSpider ID27457448

More details:

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

1,1-Dimethylethyl 4-[(3-cyano-2-pyridinyl)oxy]-1-piperidinecarboxylate
1065484-09-4 [RN]
1-Piperidinecarboxylic acid, 4-[(3-cyano-2-pyridinyl)oxy]-, 1,1-dimethylethyl ester [ACD/Index Name]
2-Methyl-2-propanyl 4-[(3-cyano-2-pyridinyl)oxy]-1-piperidinecarboxylate [ACD/IUPAC Name]
2-Methyl-2-propanyl-4-[(3-cyan-2-pyridinyl)oxy]-1-piperidincarboxylat [German] [ACD/IUPAC Name]
4-[(3-Cyano-2-pyridinyl)oxy]-1-pipéridinecarboxylate de 2-méthyl-2-propanyle [French] [ACD/IUPAC Name]
tert-Butyl 4-((3-cyanopyridin-2-yl)oxy)piperidine-1-carboxylate
4-((3-cyano-2-pyridinyl)oxy)-1-piperidinecarboxylic acid tert-butyl ester
4-(3-Cyanopyridin-2-yloxy)piperidine-1-carboxylic acid tert-butyl ester
4-(3-Cyano-pyridin-2-yloxy)-piperidine-1-carboxylic acid tert-butyl ester
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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: 437.4±45.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.1 mmHg at 25°C
    Enthalpy of Vaporization: 69.4±3.0 kJ/mol
    Flash Point: 218.4±28.7 °C
    Index of Refraction: 1.548
    Molar Refractivity: 80.8±0.4 cm3
    #H bond acceptors: 6
    #H bond donors: 0
    #Freely Rotating Bonds: 5
    #Rule of 5 Violations: 0
    ACD/LogP: 2.51
    ACD/LogD (pH 5.5): 2.38
    ACD/BCF (pH 5.5): 37.58
    ACD/KOC (pH 5.5): 466.61
    ACD/LogD (pH 7.4): 2.38
    ACD/BCF (pH 7.4): 37.58
    ACD/KOC (pH 7.4): 466.61
    Polar Surface Area: 75 Å2
    Polarizability: 32.0±0.5 10-24cm3
    Surface Tension: 52.2±5.0 dyne/cm
    Molar Volume: 254.6±5.0 cm3

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