ChemSpider 2D Image | tert-Butyl 4-hydroxy-1-oxa-7-azaspiro[4.4]nonane-7-carboxylate | C12H21NO4

tert-Butyl 4-hydroxy-1-oxa-7-azaspiro[4.4]nonane-7-carboxylate

  • Molecular FormulaC12H21NO4
  • Average mass243.299 Da
  • Monoisotopic mass243.147064 Da
  • ChemSpider ID57421336

More details:

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

1822505-03-2 [RN]
1-Oxa-7-azaspiro[4.4]nonane-7-carboxylic acid, 4-hydroxy-, 1,1-dimethylethyl ester [ACD/Index Name]
2-Methyl-2-propanyl 4-hydroxy-1-oxa-7-azaspiro[4.4]nonane-7-carboxylate [ACD/IUPAC Name]
2-Methyl-2-propanyl-4-hydroxy-1-oxa-7-azaspiro[4.4]nonan-7-carboxylat [German] [ACD/IUPAC Name]
4-Hydroxy-1-oxa-7-azaspiro[4.4]nonane-7-carboxylate de 2-méthyl-2-propanyle [French] [ACD/IUPAC Name]
tert-Butyl 4-hydroxy-1-oxa-7-azaspiro[4.4]nonane-7-carboxylate
MFCD27997306
N1(C(=O)OC(C)(C)C)CC2(OCCC2O)CC1
t-Butyl 4-hydroxy-1-oxa-7-azaspiro[4.4]nonane-7-carboxylate
Tert-Butyl 4-Hydroxy-1-Oxa-7-Azaspiro[4.4]Nonane-7-Carboxylate(WX101854)

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

    Density: 1.2±0.1 g/cm3
    Boiling Point: 376.0±37.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.9 mmHg at 25°C
    Enthalpy of Vaporization: 72.1±6.0 kJ/mol
    Flash Point: 181.2±26.5 °C
    Index of Refraction: 1.524
    Molar Refractivity: 62.5±0.4 cm3
    #H bond acceptors: 5
    #H bond donors: 1
    #Freely Rotating Bonds: 2
    #Rule of 5 Violations: 0
    ACD/LogP: 0.13
    ACD/LogD (pH 5.5): 0.75
    ACD/BCF (pH 5.5): 2.20
    ACD/KOC (pH 5.5): 61.18
    ACD/LogD (pH 7.4): 0.75
    ACD/BCF (pH 7.4): 2.20
    ACD/KOC (pH 7.4): 61.18
    Polar Surface Area: 59 Å2
    Polarizability: 24.8±0.5 10-24cm3
    Surface Tension: 45.7±5.0 dyne/cm
    Molar Volume: 204.4±5.0 cm3

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