ChemSpider 2D Image | 1-Boc-3-acetylpiperidine | C12H21NO3

1-Boc-3-acetylpiperidine

  • Molecular FormulaC12H21NO3
  • Average mass227.300 Da
  • Monoisotopic mass227.152145 Da
  • ChemSpider ID24748251

More details:

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

1-Boc-3-acetylpiperidine
858643-92-2 [RN]
(R)-1-Boc-3-acetylpiperidine
(R)-tert-butyl 3-acetylpiperidine-1-carboxylate
(S)-3-Acetyl-piperidine-1-carboxylic acid tert-butyl ester
[858643-92-2] [RN]
1008563-06-1 [RN]
1-Boc-3-acetyl-piperidine
1-N-Boc-3-acetylpiperidine
1-Piperidinecarboxylic acid, 3-acetyl-, 1,1-dimethylethyl ester [ACD/Index Name]
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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: 312.4±35.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.7 mmHg at 25°C
    Enthalpy of Vaporization: 55.3±3.0 kJ/mol
    Flash Point: 142.7±25.9 °C
    Index of Refraction: 1.474
    Molar Refractivity: 60.6±0.3 cm3
    #H bond acceptors: 4
    #H bond donors: 0
    #Freely Rotating Bonds: 3
    #Rule of 5 Violations: 0
    ACD/LogP: 1.22
    ACD/LogD (pH 5.5): 1.51
    ACD/BCF (pH 5.5): 8.24
    ACD/KOC (pH 5.5): 157.44
    ACD/LogD (pH 7.4): 1.51
    ACD/BCF (pH 7.4): 8.24
    ACD/KOC (pH 7.4): 157.44
    Polar Surface Area: 47 Å2
    Polarizability: 24.0±0.5 10-24cm3
    Surface Tension: 36.9±3.0 dyne/cm
    Molar Volume: 215.9±3.0 cm3

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