ChemSpider 2D Image | 7,8-Dihydroxy-4-methyl-2-oxo-2H-chromene-6-carboxylic acid | C11H8O6

7,8-Dihydroxy-4-methyl-2-oxo-2H-chromene-6-carboxylic acid

  • Molecular FormulaC11H8O6
  • Average mass236.178 Da
  • Monoisotopic mass236.032089 Da
  • ChemSpider ID30208811

More details:

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

2H-1-Benzopyran-6-carboxylic acid, 7,8-dihydroxy-4-methyl-2-oxo- [ACD/Index Name]
7,8-Dihydroxy-4-methyl-2-oxo-2H-chromen-6-carbonsäure [German] [ACD/IUPAC Name]
7,8-Dihydroxy-4-methyl-2-oxo-2H-chromene-6-carboxylic acid [ACD/IUPAC Name]
Acide 7,8-dihydroxy-4-méthyl-2-oxo-2H-chromène-6-carboxylique [French] [ACD/IUPAC Name]
7,8-dihydroxy-4-methyl-2-oxochromene-6-carboxylic acid
855286-70-3 [RN]
AGN-PC-087KVF
AN-829/25073007
MFCD18083848 [MDL number]
MolPort-019-724-217
More...

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

    Density: 1.6±0.1 g/cm3
    Boiling Point: 519.3±50.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.4 mmHg at 25°C
    Enthalpy of Vaporization: 83.4±3.0 kJ/mol
    Flash Point: 211.1±23.6 °C
    Index of Refraction: 1.689
    Molar Refractivity: 55.2±0.3 cm3
    #H bond acceptors: 6
    #H bond donors: 3
    #Freely Rotating Bonds: 1
    #Rule of 5 Violations: 0
    ACD/LogP: 3.12
    ACD/LogD (pH 5.5): -0.83
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 1.00
    ACD/LogD (pH 7.4): -1.00
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 104 Å2
    Polarizability: 21.9±0.5 10-24cm3
    Surface Tension: 80.6±3.0 dyne/cm
    Molar Volume: 144.5±3.0 cm3

    Click to predict properties on the Chemicalize site


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