ChemSpider 2D Image | Benzyl 4-oxo-2-propyl-1-piperidinecarboxylate | C16H21NO3

Benzyl 4-oxo-2-propyl-1-piperidinecarboxylate

  • Molecular FormulaC16H21NO3
  • Average mass275.343 Da
  • Monoisotopic mass275.152130 Da
  • ChemSpider ID26528503

More details:

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

1245646-49-4 [RN]
1-Piperidinecarboxylic acid, 4-oxo-2-propyl-, phenylmethyl ester [ACD/Index Name]
4-Oxo-2-propyl-1-pipéridinecarboxylate de benzyle [French] [ACD/IUPAC Name]
Benzyl 4-oxo-2-propyl-1-piperidinecarboxylate [ACD/IUPAC Name]
Benzyl 4-oxo-2-propylpiperidine-1-carboxylate
Benzyl-4-oxo-2-propyl-1-piperidincarboxylat [German] [ACD/IUPAC Name]
(S)-Benzyl 4-oxo-2-propylpiperidine-1-carboxylate
1391729-81-9 [RN]
142764-70-3 [RN]
1-Cbz-2-propylpiperidin-4-one
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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: 1.1±0.1 g/cm3
    Boiling Point: 413.4±45.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.0 mmHg at 25°C
    Enthalpy of Vaporization: 66.6±3.0 kJ/mol
    Flash Point: 203.8±28.7 °C
    Index of Refraction: 1.530
    Molar Refractivity: 76.2±0.3 cm3
    #H bond acceptors: 4
    #H bond donors: 0
    #Freely Rotating Bonds: 5
    #Rule of 5 Violations: 0
    ACD/LogP: 2.55
    ACD/LogD (pH 5.5): 2.75
    ACD/BCF (pH 5.5): 72.18
    ACD/KOC (pH 5.5): 744.48
    ACD/LogD (pH 7.4): 2.75
    ACD/BCF (pH 7.4): 72.18
    ACD/KOC (pH 7.4): 744.48
    Polar Surface Area: 47 Å2
    Polarizability: 30.2±0.5 10-24cm3
    Surface Tension: 42.7±3.0 dyne/cm
    Molar Volume: 246.4±3.0 cm3

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