ChemSpider 2D Image | (S)-tert-Butyl 3-(oxetan-3-ylamino)piperidine-1-carboxylate | C13H24N2O3

(S)-tert-Butyl 3-(oxetan-3-ylamino)piperidine-1-carboxylate

  • Molecular FormulaC13H24N2O3
  • Average mass256.341 Da
  • Monoisotopic mass256.178680 Da
  • ChemSpider ID26499598

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(3S)-3-(3-Oxétanylamino)-1-pipéridinecarboxylate de 2-méthyl-2-propanyle [French] [ACD/IUPAC Name]
(S)-tert-Butyl 3-(oxetan-3-ylamino)piperidine-1-carboxylate
1349702-25-5 [RN]
1-Piperidinecarboxylic acid, 3-(3-oxetanylamino)-, 1,1-dimethylethyl ester, (3S)- [ACD/Index Name]
2-Methyl-2-propanyl (3S)-3-(3-oxetanylamino)-1-piperidinecarboxylate [ACD/IUPAC Name]
2-Methyl-2-propanyl-(3S)-3-(3-oxetanylamino)-1-piperidincarboxylat [German] [ACD/IUPAC Name]
(S)-tert-Butyl 3-(oxetan-3-ylamino)-piperidine-1-carboxylate
(S)-tert-Butyl3-(oxetan-3-ylamino)piperidine-1-carboxylate
1334499-75-0 [RN]
BENZYL-1,6-DIAZASPIRO-[3.5]-NONANE-6-CARBOXYLATE
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.1±0.1 g/cm3
    Boiling Point: 357.5±42.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.8 mmHg at 25°C
    Enthalpy of Vaporization: 60.3±3.0 kJ/mol
    Flash Point: 170.0±27.9 °C
    Index of Refraction: 1.511
    Molar Refractivity: 69.2±0.4 cm3
    #H bond acceptors: 5
    #H bond donors: 1
    #Freely Rotating Bonds: 4
    #Rule of 5 Violations: 0
    ACD/LogP: 0.33
    ACD/LogD (pH 5.5): -0.80
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 1.03
    ACD/LogD (pH 7.4): 0.84
    ACD/BCF (pH 7.4): 2.06
    ACD/KOC (pH 7.4): 45.05
    Polar Surface Area: 51 Å2
    Polarizability: 27.5±0.5 10-24cm3
    Surface Tension: 40.9±5.0 dyne/cm
    Molar Volume: 231.1±5.0 cm3

    Click to predict properties on the Chemicalize site


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