ChemSpider 2D Image | tert-Butyl 5'-oxo-8-azaspiro[bicyclo[3.2.1]octane-3,3'-pyrrolidine]-8-carboxylate | C15H24N2O3

tert-Butyl 5'-oxo-8-azaspiro[bicyclo[3.2.1]octane-3,3'-pyrrolidine]-8-carboxylate

  • Molecular FormulaC15H24N2O3
  • Average mass280.363 Da
  • Monoisotopic mass280.178680 Da
  • ChemSpider ID23500378

More details:

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

1263279-47-5 [RN]
2-Methyl-2-propanyl 5'-oxo-8H-spiro[8-azabicyclo[3.2.1]octane-3,3'-pyrrolidine]-8-carboxylate [ACD/IUPAC Name]
Spiro[8-azabicyclo[3.2.1]octane-3,3'-pyrrolidine]-8-carboxylic acid, 5'-oxo-, 1,1-dimethylethyl ester [ACD/Index Name]
tert-Butyl 5'-oxo-8-azaspiro[bicyclo[3.2.1]octane-3,3'-pyrrolidine]-8-carboxylate
tert-Butyl 5'-oxo-8H-spiro[8-azabicyclo[3.2.1]octane-3,3'-pyrrolidine]-8-carboxylate
(1R,3s,5S)-tert-butyl 5'-oxo-8-azaspiro[bicyclo[3.2.1]octane-3,3'-pyrrolidine]-8-carboxylate
MFCD11616039 [MDL number]
Spiro[8-azabicyclo[3.2.1]octane-3,3'-pyrrolidine]-8-carboxylic acid, 5'-oxo-, 1,1-dimethylethyl es
tert-butyl 3-oxo-2,8-diazatricyclo[7.9.{4,5}]trideca-8-carboxylate
Untitled Document

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

    Density: 1.2±0.1 g/cm3
    Boiling Point: 454.5±45.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.1 mmHg at 25°C
    Enthalpy of Vaporization: 71.4±3.0 kJ/mol
    Flash Point: 228.7±28.7 °C
    Index of Refraction: 1.547
    Molar Refractivity: 74.8±0.4 cm3
    #H bond acceptors: 5
    #H bond donors: 1
    #Freely Rotating Bonds: 2
    #Rule of 5 Violations: 0
    ACD/LogP: 0.39
    ACD/LogD (pH 5.5): 1.36
    ACD/BCF (pH 5.5): 6.30
    ACD/KOC (pH 5.5): 130.03
    ACD/LogD (pH 7.4): 1.36
    ACD/BCF (pH 7.4): 6.30
    ACD/KOC (pH 7.4): 130.03
    Polar Surface Area: 59 Å2
    Polarizability: 29.7±0.5 10-24cm3
    Surface Tension: 46.4±5.0 dyne/cm
    Molar Volume: 236.0±5.0 cm3

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