ChemSpider 2D Image | tert-butyl 4-oxo-8-oxa-3,10-diazabicyclo[4.3.1]decane-10-carboxylate | C12H20N2O4

tert-butyl 4-oxo-8-oxa-3,10-diazabicyclo[4.3.1]decane-10-carboxylate

  • Molecular FormulaC12H20N2O4
  • Average mass256.298 Da
  • Monoisotopic mass256.142303 Da
  • ChemSpider ID28601110

More details:

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

1160248-56-5 [RN]
2-Methyl-2-propanyl 4-oxo-8-oxa-3,10-diazabicyclo[4.3.1]decane-10-carboxylate [ACD/IUPAC Name]
2-Methyl-2-propanyl-4-oxo-8-oxa-3,10-diazabicyclo[4.3.1]decan-10-carboxylat [German] [ACD/IUPAC Name]
4-Oxo-8-oxa-3,10-diazabicyclo[4.3.1]décane-10-carboxylate de 2-méthyl-2-propanyle [French] [ACD/IUPAC Name]
8-Oxa-3,10-diazabicyclo[4.3.1]decane-10-carboxylic acid, 4-oxo-, 1,1-dimethylethyl ester [ACD/Index Name]
tert-butyl 4-oxo-8-oxa-3,10-diazabicyclo[4.3.1]decane-10-carboxylate
10-benzyl-8-oxa-3,10-diazabicyclo[4.3.1]decan-4-one [ACD/IUPAC Name]
4-Oxo-8-oxa-3,10-diaza-bicyclo[4.3. 1]decane-10-carboxylic acid tert-butyl ester
AGN-PC-0HTQYY
AM805478
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.2±0.1 g/cm3
    Boiling Point: 436.2±45.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.0 mmHg at 25°C
    Enthalpy of Vaporization: 69.3±3.0 kJ/mol
    Flash Point: 217.6±28.7 °C
    Index of Refraction: 1.491
    Molar Refractivity: 63.8±0.3 cm3
    #H bond acceptors: 6
    #H bond donors: 1
    #Freely Rotating Bonds: 2
    #Rule of 5 Violations: 0
    ACD/LogP: -0.67
    ACD/LogD (pH 5.5): 0.12
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 27.67
    ACD/LogD (pH 7.4): 0.12
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 27.67
    Polar Surface Area: 68 Å2
    Polarizability: 25.3±0.5 10-24cm3
    Surface Tension: 38.7±3.0 dyne/cm
    Molar Volume: 220.2±3.0 cm3

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