ChemSpider 2D Image | tert-butyl 2-bromo-7-azaspiro[3.5]nonane-7-carboxylate | C13H22BrNO2

tert-butyl 2-bromo-7-azaspiro[3.5]nonane-7-carboxylate

  • Molecular FormulaC13H22BrNO2
  • Average mass304.223 Da
  • Monoisotopic mass303.083374 Da
  • ChemSpider ID26518715

More details:

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

1225276-07-2 [RN]
2-Bromo-7-azaspiro[3.5]nonane-7-carboxylate de 2-méthyl-2-propanyle [French] [ACD/IUPAC Name]
2-Methyl-2-propanyl 2-bromo-7-azaspiro[3.5]nonane-7-carboxylate [ACD/IUPAC Name]
2-Methyl-2-propanyl-2-brom-7-azaspiro[3.5]nonan-7-carboxylat [German] [ACD/IUPAC Name]
7-Azaspiro[3.5]nonane-7-carboxylic acid, 2-bromo-, 1,1-dimethylethyl ester [ACD/Index Name]
tert-butyl 2-bromo-7-azaspiro[3.5]nonane-7-carboxylate
Chemistry 17311
MFCD24471158
t-Butyl 2-bromo-7-azaspiro[3.5]nonane-7-carboxylate

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

    Density: 1.3±0.1 g/cm3
    Boiling Point: 354.1±42.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.8 mmHg at 25°C
    Enthalpy of Vaporization: 59.9±3.0 kJ/mol
    Flash Point: 167.9±27.9 °C
    Index of Refraction: 1.534
    Molar Refractivity: 71.6±0.4 cm3
    #H bond acceptors: 3
    #H bond donors: 0
    #Freely Rotating Bonds: 2
    #Rule of 5 Violations: 0
    ACD/LogP: 2.83
    ACD/LogD (pH 5.5): 2.97
    ACD/BCF (pH 5.5): 107.29
    ACD/KOC (pH 5.5): 988.74
    ACD/LogD (pH 7.4): 2.97
    ACD/BCF (pH 7.4): 107.29
    ACD/KOC (pH 7.4): 988.74
    Polar Surface Area: 30 Å2
    Polarizability: 28.4±0.5 10-24cm3
    Surface Tension: 42.1±5.0 dyne/cm
    Molar Volume: 230.4±5.0 cm3

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