ChemSpider 2D Image | tert-Butyl 2'-oxo-1',2'-dihydrospiro[piperidine-4,3'-pyrrolo[2,3-b]pyridine]-1-carboxylate | C16H21N3O3

tert-Butyl 2'-oxo-1',2'-dihydrospiro[piperidine-4,3'-pyrrolo[2,3-b]pyridine]-1-carboxylate

  • Molecular FormulaC16H21N3O3
  • Average mass303.356 Da
  • Monoisotopic mass303.158295 Da
  • ChemSpider ID29356806

More details:

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

2-Methyl-2-propanyl 2'-oxo-1',2'-dihydro-1H-spiro[piperidine-4,3'-pyrrolo[2,3-b]pyridine]-1-carboxylate [ACD/IUPAC Name]
885031-86-7 [RN]
Spiro[piperidine-4,3'-[3H]pyrrolo[2,3-b]pyridine]-1-carboxylic acid, 1',2'-dihydro-2'-oxo-, 1,1-dimethylethyl ester [ACD/Index Name]
tert-Butyl 2'-oxo-1',2'-dihydrospiro[piperidine-4,3'-pyrrolo[2,3-b]pyridine]-1-carboxylate
1-boc-2-oxo-1,2-dihydrospiro[piperidine-4,3-pyrrolo[2,3-b]pyridine]
1-BOC-2'-OXO-1',2'-DIHYDROSPIRO[PIPERIDINE-4,3'-PYRROLO[2,3-B]PYRIDINE]
KS-10377
MFCD17926161
spiro[piperidine-4,3'-[3h]pyrrolo[2,3-b]pyridine]-1-carboxylic acid,1',2'-dihydro-2'-oxo-,1,1-dimethylethyl ester
tert-butyl 2'-oxo-1',2'-dihydro-1H-spiro[piperidine-4,3'-pyrrolo[2,3-b]pyridine]-1-carboxylate
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.3±0.1 g/cm3
    Boiling Point: 496.4±45.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.3 mmHg at 25°C
    Enthalpy of Vaporization: 76.4±3.0 kJ/mol
    Flash Point: 254.0±28.7 °C
    Index of Refraction: 1.588
    Molar Refractivity: 80.9±0.4 cm3
    #H bond acceptors: 6
    #H bond donors: 1
    #Freely Rotating Bonds: 2
    #Rule of 5 Violations: 0
    ACD/LogP: 2.06
    ACD/LogD (pH 5.5): 2.54
    ACD/BCF (pH 5.5): 49.85
    ACD/KOC (pH 5.5): 571.03
    ACD/LogD (pH 7.4): 2.54
    ACD/BCF (pH 7.4): 49.90
    ACD/KOC (pH 7.4): 571.63
    Polar Surface Area: 72 Å2
    Polarizability: 32.1±0.5 10-24cm3
    Surface Tension: 55.8±5.0 dyne/cm
    Molar Volume: 240.3±5.0 cm3

    Click to predict properties on the Chemicalize site


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