ChemSpider 2D Image | 1-Boc-3-formyl-4-oxo-piperidine | C11H17NO4

1-Boc-3-formyl-4-oxo-piperidine

  • Molecular FormulaC11H17NO4
  • Average mass227.257 Da
  • Monoisotopic mass227.115753 Da
  • ChemSpider ID26000494

More details:

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

100501-55-1 [RN]
1-Boc-3-formyl-4-oxo-piperidine
1-Piperidinecarboxylic acid, 3-formyl-4-oxo-, 1,1-dimethylethyl ester [ACD/Index Name]
2-Methyl-2-propanyl 3-formyl-4-oxo-1-piperidinecarboxylate [ACD/IUPAC Name]
2-Methyl-2-propanyl-3-formyl-4-oxo-1-piperidincarboxylat [German] [ACD/IUPAC Name]
3-Formyl-4-oxo-1-pipéridinecarboxylate de 2-méthyl-2-propanyle [French] [ACD/IUPAC Name]
[100501-55-1] [RN]
1-Boc-3-formyl-4-oxopiperidine
1-N-Boc-3-formyl-4-oxopiperidine
3-Formyl-4-oxo-piperidine-1-carboxylic acid tert-butyl ester
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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: 1.2±0.1 g/cm3
    Boiling Point: 342.3±42.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.8 mmHg at 25°C
    Enthalpy of Vaporization: 58.6±3.0 kJ/mol
    Flash Point: 160.8±27.9 °C
    Index of Refraction: 1.532
    Molar Refractivity: 58.2±0.3 cm3
    #H bond acceptors: 5
    #H bond donors: 0
    #Freely Rotating Bonds: 3
    #Rule of 5 Violations: 0
    ACD/LogP: 0.22
    ACD/LogD (pH 5.5): 0.56
    ACD/BCF (pH 5.5): 1.51
    ACD/KOC (pH 5.5): 44.09
    ACD/LogD (pH 7.4): -0.60
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 3.03
    Polar Surface Area: 64 Å2
    Polarizability: 23.1±0.5 10-24cm3
    Surface Tension: 50.8±3.0 dyne/cm
    Molar Volume: 187.8±3.0 cm3

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