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Search term: ACRUCDPQQCIOID (Found by InChIKey (skeleton match))
ChemSpider 2D Image | 5-Hydroxy-1,3-cyclohexanedione | C6H8O3

5-Hydroxy-1,3-cyclohexanedione

  • Molecular FormulaC6H8O3
  • Average mass128.126 Da
  • Monoisotopic mass128.047348 Da
  • ChemSpider ID45532066

More details:

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

1,3-Cyclohexanedione, 5-hydroxy- [ACD/Index Name]
5-Hydroxy-1,3-cyclohexandion [German] [ACD/IUPAC Name]
5-Hydroxy-1,3-cyclohexanedione [ACD/IUPAC Name]
5-Hydroxy-1,3-cyclohexanedione [French] [ACD/IUPAC Name]
204844-83-7 [RN]
5-HYDROXYCYCLOHEXANE-1,3-DIONE
MFCD24702964

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

    Density: 1.3±0.1 g/cm3
    Boiling Point: 318.4±42.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.5 mmHg at 25°C
    Enthalpy of Vaporization: 64.9±6.0 kJ/mol
    Flash Point: 160.6±24.4 °C
    Index of Refraction: 1.524
    Molar Refractivity: 29.5±0.3 cm3
    #H bond acceptors: 3
    #H bond donors: 1
    #Freely Rotating Bonds: 0
    #Rule of 5 Violations: 0
    ACD/LogP: -1.98
    ACD/LogD (pH 5.5): -1.72
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 1.00
    ACD/LogD (pH 7.4): -3.02
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 54 Å2
    Polarizability: 11.7±0.5 10-24cm3
    Surface Tension: 57.9±3.0 dyne/cm
    Molar Volume: 96.4±3.0 cm3

    Click to predict properties on the Chemicalize site


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