ChemSpider 2D Image | 6-methyl-8-nitro-4-oxochromene-3-carbaldehyde | C11H7NO5

6-methyl-8-nitro-4-oxochromene-3-carbaldehyde

  • Molecular FormulaC11H7NO5
  • Average mass233.177 Da
  • Monoisotopic mass233.032425 Da
  • ChemSpider ID21801065

More details:

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

4H-1-Benzopyran-3-carboxaldehyde, 6-methyl-8-nitro-4-oxo- [ACD/Index Name]
6-Methyl-8-nitro-4-oxo-4H-chromen-3-carbaldehyd [German] [ACD/IUPAC Name]
6-Methyl-8-nitro-4-oxo-4H-chromene-3-carbaldehyde [ACD/IUPAC Name]
6-Méthyl-8-nitro-4-oxo-4H-chromène-3-carbaldéhyde [French] [ACD/IUPAC Name]
6-methyl-8-nitro-4-oxochromene-3-carbaldehyde
879559-54-3 [RN]
6-Methyl-8-nitro-4-oxo-4H-1-benzopyran-3-carbaldehyde
AG-A-90591
AKOS005171818
ALBB-008109
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

MFCD11899888 [DBID]

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

    Density: 1.6±0.1 g/cm3
    Boiling Point: 430.7±45.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.0 mmHg at 25°C
    Enthalpy of Vaporization: 68.6±3.0 kJ/mol
    Flash Point: 214.0±30.7 °C
    Index of Refraction: 1.698
    Molar Refractivity: 57.7±0.3 cm3
    #H bond acceptors: 6
    #H bond donors: 0
    #Freely Rotating Bonds: 2
    #Rule of 5 Violations: 0
    ACD/LogP: 1.23
    ACD/LogD (pH 5.5): 1.34
    ACD/BCF (pH 5.5): 6.15
    ACD/KOC (pH 5.5): 127.68
    ACD/LogD (pH 7.4): 1.34
    ACD/BCF (pH 7.4): 6.15
    ACD/KOC (pH 7.4): 127.68
    Polar Surface Area: 89 Å2
    Polarizability: 22.9±0.5 10-24cm3
    Surface Tension: 78.8±3.0 dyne/cm
    Molar Volume: 149.8±3.0 cm3

    Click to predict properties on the Chemicalize site


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