ChemSpider 2D Image | 2-Oxa-6-azaspiro[3.4]octan-7-one | C6H9NO2

2-Oxa-6-azaspiro[3.4]octan-7-one

  • Molecular FormulaC6H9NO2
  • Average mass127.141 Da
  • Monoisotopic mass127.063332 Da
  • ChemSpider ID23499675

More details:






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

1207174-87-5 [RN]
2-Oxa-6-azaspiro[3.4]octan-7-on [German] [ACD/IUPAC Name]
2-Oxa-6-azaspiro[3.4]octan-7-one [ACD/Index Name] [ACD/IUPAC Name]
2-Oxa-6-azaspiro[3.4]octan-7-one [French] [ACD/Index Name] [ACD/IUPAC Name]
6-Aza-2-oxaspiro[3.4]octan-7-one
T5MV DXTJ D-& CT4O CXTJ [WLN]
[1207174-87-5] [RN]
2-Oxa-6-aza-spiro[3.4]octan-7-one
2-OXA-6-AZASPIRO-[3.4]-OCTAN-7-ONE
2-oxa-7-azaspiro[3.4]octan-6-one
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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: 1.2±0.1 g/cm3
    Boiling Point: 353.9±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: 167.8±27.9 °C
    Index of Refraction: 1.525
    Molar Refractivity: 31.3±0.4 cm3
    #H bond acceptors: 3
    #H bond donors: 1
    #Freely Rotating Bonds: 0
    #Rule of 5 Violations: 0
    ACD/LogP: -1.81
    ACD/LogD (pH 5.5): -1.30
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 4.70
    ACD/LogD (pH 7.4): -1.30
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 4.70
    Polar Surface Area: 38 Å2
    Polarizability: 12.4±0.5 10-24cm3
    Surface Tension: 42.9±5.0 dyne/cm
    Molar Volume: 102.1±5.0 cm3

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