ChemSpider 2D Image | 2-Methyl-2-propanyl (3R)-3-ethynyl-1-piperidinecarboxylate | C12H19NO2

2-Methyl-2-propanyl (3R)-3-ethynyl-1-piperidinecarboxylate

  • Molecular FormulaC12H19NO2
  • Average mass209.285 Da
  • Monoisotopic mass209.141586 Da
  • ChemSpider ID32792377

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(3R)-3-Éthynyl-1-pipéridinecarboxylate de 2-méthyl-2-propanyle [French] [ACD/IUPAC Name]
1-Piperidinecarboxylic acid, 3-ethynyl-, 1,1-dimethylethyl ester, (3R)- [ACD/Index Name]
2-Methyl-2-propanyl (3R)-3-ethynyl-1-piperidinecarboxylate [ACD/IUPAC Name]
2-Methyl-2-propanyl-(3R)-3-ethinyl-1-piperidincarboxylat [German] [ACD/IUPAC Name]
(3R)-3-Ethynyl-1-piperidinecarboxylic acid 1,1-dimethylethyl ester
(R)-tert-butyl 3-ethynylpiperidine-1-carboxylate
287192-99-8 [RN]
MFCD17676499
tert-butyl (3R)-3-ethynylpiperidine-1-carboxylate
tert-butyl (R)-3-ethynylpiperidine-1-carboxylate

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

    Density: 1.0±0.1 g/cm3
    Boiling Point: 269.6±29.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.6 mmHg at 25°C
    Enthalpy of Vaporization: 50.8±3.0 kJ/mol
    Flash Point: 116.8±24.3 °C
    Index of Refraction: 1.491
    Molar Refractivity: 59.1±0.4 cm3
    #H bond acceptors: 3
    #H bond donors: 0
    #Freely Rotating Bonds: 3
    #Rule of 5 Violations: 0
    ACD/LogP: 2.09
    ACD/LogD (pH 5.5): 2.61
    ACD/BCF (pH 5.5): 56.48
    ACD/KOC (pH 5.5): 624.61
    ACD/LogD (pH 7.4): 2.61
    ACD/BCF (pH 7.4): 56.48
    ACD/KOC (pH 7.4): 624.61
    Polar Surface Area: 30 Å2
    Polarizability: 23.4±0.5 10-24cm3
    Surface Tension: 38.1±5.0 dyne/cm
    Molar Volume: 204.0±5.0 cm3

    Click to predict properties on the Chemicalize site


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