ChemSpider 2D Image | 6-Oxospiro[3.3]heptane-2-carboxylic acid | C8H10O3

6-Oxospiro[3.3]heptane-2-carboxylic acid

  • Molecular FormulaC8H10O3
  • Average mass154.163 Da
  • Monoisotopic mass154.062988 Da
  • ChemSpider ID21541215

More details:

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

6-Oxospiro[3.3]heptan-2-carbonsäure [German] [ACD/IUPAC Name]
6-Oxospiro[3.3]heptane-2-carboxylic acid [ACD/IUPAC Name]
889944-57-4 [RN]
Acide 6-oxospiro[3.3]heptane-2-carboxylique [French] [ACD/IUPAC Name]
MFCD08436470 [MDL number]
Spiro[3.3]heptane-2-carboxylic acid, 6-oxo- [ACD/Index Name]
2-oxospiro[3.3]heptane-6-carboxylic acid
6-Oxospiro(3,3,)heptanes-2-carboxylic acid
6-oxospiro[3.3]heptane-2-carboxylicacid
937661-25-1 [RN]
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

CCRIS 4693 [DBID]

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

    Density: 1.3±0.1 g/cm3
    Boiling Point: 345.6±42.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.6 mmHg at 25°C
    Enthalpy of Vaporization: 64.8±6.0 kJ/mol
    Flash Point: 177.0±24.4 °C
    Index of Refraction: 1.544
    Molar Refractivity: 36.8±0.4 cm3
    #H bond acceptors: 3
    #H bond donors: 1
    #Freely Rotating Bonds: 1
    #Rule of 5 Violations: 0
    ACD/LogP: -0.35
    ACD/LogD (pH 5.5): -1.11
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 1.98
    ACD/LogD (pH 7.4): -2.91
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 54 Å2
    Polarizability: 14.6±0.5 10-24cm3
    Surface Tension: 52.3±5.0 dyne/cm
    Molar Volume: 116.4±5.0 cm3

    Click to predict properties on the Chemicalize site


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