ChemSpider 2D Image | tert-Butyl 4-oxo-2-propylpiperidine-1-carboxylate | C13H23NO3

tert-Butyl 4-oxo-2-propylpiperidine-1-carboxylate

  • Molecular FormulaC13H23NO3
  • Average mass241.327 Da
  • Monoisotopic mass241.167801 Da
  • ChemSpider ID26528207

More details:

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

1245643-80-4 [RN]
1-Piperidinecarboxylic acid, 4-oxo-2-propyl-, 1,1-dimethylethyl ester [ACD/Index Name]
2-Methyl-2-propanyl 4-oxo-2-propyl-1-piperidinecarboxylate [ACD/IUPAC Name]
2-Methyl-2-propanyl-4-oxo-2-propyl-1-piperidincarboxylat [German] [ACD/IUPAC Name]
4-Oxo-2-propyl-1-pipéridinecarboxylate de 2-méthyl-2-propanyle [French] [ACD/IUPAC Name]
tert-Butyl 4-oxo-2-propylpiperidine-1-carboxylate
1-Boc-2-n-propyl-piperidin-4-one
1-Boc-2-propylpiperidin-4-one
1-BOC-2-PROPYL-PIPERIDIN-4-ONE
MFCD07367730 [MDL number]
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

CCRIS 4693 [DBID]

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

    Density: 1.0±0.1 g/cm3
    Boiling Point: 331.4±35.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.7 mmHg at 25°C
    Enthalpy of Vaporization: 57.4±3.0 kJ/mol
    Flash Point: 154.2±25.9 °C
    Index of Refraction: 1.469
    Molar Refractivity: 65.5±0.3 cm3
    #H bond acceptors: 4
    #H bond donors: 0
    #Freely Rotating Bonds: 4
    #Rule of 5 Violations: 0
    ACD/LogP: 1.94
    ACD/LogD (pH 5.5): 2.02
    ACD/BCF (pH 5.5): 20.30
    ACD/KOC (pH 5.5): 300.31
    ACD/LogD (pH 7.4): 2.02
    ACD/BCF (pH 7.4): 20.30
    ACD/KOC (pH 7.4): 300.31
    Polar Surface Area: 47 Å2
    Polarizability: 26.0±0.5 10-24cm3
    Surface Tension: 35.0±3.0 dyne/cm
    Molar Volume: 235.3±3.0 cm3

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