ChemSpider 2D Image | tert-butyl (3S)-3-acetylpiperidine-1-carboxylate | C12H21NO3

tert-butyl (3S)-3-acetylpiperidine-1-carboxylate

  • Molecular FormulaC12H21NO3
  • Average mass227.300 Da
  • Monoisotopic mass227.152145 Da
  • ChemSpider ID32791314

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(3S)-3-Acétyl-1-pipéridinecarboxylate de 2-méthyl-2-propanyle [French] [ACD/IUPAC Name]
1008563-06-1 [RN]
1-Piperidinecarboxylic acid, 3-acetyl-, 1,1-dimethylethyl ester, (3S)- [ACD/Index Name]
2-Methyl-2-propanyl (3S)-3-acetyl-1-piperidinecarboxylate [ACD/IUPAC Name]
2-Methyl-2-propanyl-(3S)-3-acetyl-1-piperidincarboxylat [German] [ACD/IUPAC Name]
tert-butyl (3S)-3-acetylpiperidine-1-carboxylate
(R)-1-Boc-3-acetylpiperidine
(S)-1-Boc-3-acetylpiperidine
(S)-1-Boc-3-acetyl-piperidine
(S)-tert-Butyl 3-acetylpiperidine-1-carboxylate
More...

    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

    Click to predict properties on the Chemicalize site


    Advertisement