ChemSpider 2D Image | tert-Butyl 4-cyano-4-(3-methoxyphenyl)piperidine-1-carboxylate | C18H24N2O3

tert-Butyl 4-cyano-4-(3-methoxyphenyl)piperidine-1-carboxylate

  • Molecular FormulaC18H24N2O3
  • Average mass316.395 Da
  • Monoisotopic mass316.178680 Da
  • ChemSpider ID28536530

More details:

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

1-Piperidinecarboxylic acid, 4-cyano-4-(3-methoxyphenyl)-, 1,1-dimethylethyl ester [ACD/Index Name]
2-Methyl-2-propanyl 4-cyano-4-(3-methoxyphenyl)-1-piperidinecarboxylate [ACD/IUPAC Name]
2-Methyl-2-propanyl-4-cyan-4-(3-methoxyphenyl)-1-piperidincarboxylat [German] [ACD/IUPAC Name]
4-Cyano-4-(3-méthoxyphényl)-1-pipéridinecarboxylate de 2-méthyl-2-propanyle [French] [ACD/IUPAC Name]
553631-35-9 [RN]
tert-Butyl 4-cyano-4-(3-methoxyphenyl)piperidine-1-carboxylate
[553631-35-9] [RN]
1-Boc-4-cyano-4-(3-methoxyphenyl)-piperidine
MFCD11849790 [MDL number]
tert-Butyl4-cyano-4-(3-methoxyphenyl)piperidine-1-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: 464.4±45.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.1 mmHg at 25°C
    Enthalpy of Vaporization: 72.6±3.0 kJ/mol
    Flash Point: 234.7±28.7 °C
    Index of Refraction: 1.544
    Molar Refractivity: 87.7±0.4 cm3
    #H bond acceptors: 5
    #H bond donors: 0
    #Freely Rotating Bonds: 5
    #Rule of 5 Violations: 0
    ACD/LogP: 2.60
    ACD/LogD (pH 5.5): 3.23
    ACD/BCF (pH 5.5): 167.32
    ACD/KOC (pH 5.5): 1358.99
    ACD/LogD (pH 7.4): 3.23
    ACD/BCF (pH 7.4): 167.32
    ACD/KOC (pH 7.4): 1358.99
    Polar Surface Area: 63 Å2
    Polarizability: 34.8±0.5 10-24cm3
    Surface Tension: 47.0±5.0 dyne/cm
    Molar Volume: 277.7±5.0 cm3

    Click to predict properties on the Chemicalize site


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