ChemSpider 2D Image | 6-Oxospiro[3.3]heptane-2,2-dicarboxylic acid | C9H10O5

6-Oxospiro[3.3]heptane-2,2-dicarboxylic acid

  • Molecular FormulaC9H10O5
  • Average mass198.173 Da
  • Monoisotopic mass198.052826 Da
  • ChemSpider ID21783070

More details:

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

1023814-92-7 [RN]
6-Oxospiro[3.3]heptan-2,2-dicarbonsäure [German] [ACD/IUPAC Name]
6-Oxospiro[3.3]heptane-2,2-dicarboxylic acid [ACD/IUPAC Name]
Acide 6-oxospiro[3.3]heptane-2,2-dicarboxylique [French] [ACD/IUPAC Name]
Spiro[3.3]heptane-2,2-dicarboxylic acid, 6-oxo- [ACD/Index Name]
6-oxospiro[3.3]heptane-2,2-dicarboxylicacid
MFCD09754283 [MDL number]

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

    Density: 1.6±0.1 g/cm3
    Boiling Point: 487.9±45.0 °C at 760 mmHg
    Vapour Pressure: 0.0±2.7 mmHg at 25°C
    Enthalpy of Vaporization: 82.6±6.0 kJ/mol
    Flash Point: 263.0±25.2 °C
    Index of Refraction: 1.592
    Molar Refractivity: 43.1±0.4 cm3
    #H bond acceptors: 5
    #H bond donors: 2
    #Freely Rotating Bonds: 2
    #Rule of 5 Violations: 0
    ACD/LogP: -0.56
    ACD/LogD (pH 5.5): -3.80
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 1.00
    ACD/LogD (pH 7.4): -4.43
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 92 Å2
    Polarizability: 17.1±0.5 10-24cm3
    Surface Tension: 74.1±5.0 dyne/cm
    Molar Volume: 127.3±5.0 cm3

    Click to predict properties on the Chemicalize site


    Advertisement