ChemSpider 2D Image | tert-Butyl 2-(aminomethyl)-1-oxa-7-azaspiro[3.5]nonane-7-carboxylate | C13H24N2O3

tert-Butyl 2-(aminomethyl)-1-oxa-7-azaspiro[3.5]nonane-7-carboxylate

  • Molecular FormulaC13H24N2O3
  • Average mass256.341 Da
  • Monoisotopic mass256.178680 Da
  • ChemSpider ID28467439

More details:

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

1403766-68-6 [RN]
1-Oxa-7-azaspiro[3.5]nonane-7-carboxylic acid, 2-(aminomethyl)-, 1,1-dimethylethyl ester [ACD/Index Name]
2-(Aminométhyl)-1-oxa-7-azaspiro[3.5]nonane-7-carboxylate de 2-méthyl-2-propanyle [French] [ACD/IUPAC Name]
2-Methyl-2-propanyl 2-(aminomethyl)-1-oxa-7-azaspiro[3.5]nonane-7-carboxylate [ACD/IUPAC Name]
2-Methyl-2-propanyl-2-(aminomethyl)-1-oxa-7-azaspiro[3.5]nonan-7-carboxylat [German] [ACD/IUPAC Name]
tert-Butyl 2-(aminomethyl)-1-oxa-7-azaspiro[3.5]nonane-7-carboxylate
MFCD22628730 [MDL number]
MolPort-030-086-474
PB38616
Q-4917
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

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

    Density: 1.1±0.1 g/cm3
    Boiling Point: 367.4±27.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.8 mmHg at 25°C
    Enthalpy of Vaporization: 61.4±3.0 kJ/mol
    Flash Point: 176.0±23.7 °C
    Index of Refraction: 1.522
    Molar Refractivity: 69.3±0.4 cm3
    #H bond acceptors: 5
    #H bond donors: 2
    #Freely Rotating Bonds: 3
    #Rule of 5 Violations: 0
    ACD/LogP: 0.29
    ACD/LogD (pH 5.5): -2.53
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 1.00
    ACD/LogD (pH 7.4): -1.50
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 65 Å2
    Polarizability: 27.5±0.5 10-24cm3
    Surface Tension: 43.9±5.0 dyne/cm
    Molar Volume: 226.9±5.0 cm3

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