ChemSpider 2D Image | Ethyl 7-bromo-2-oxochromene-3-carboxylate | C12H9BrO4

Ethyl 7-bromo-2-oxochromene-3-carboxylate

  • Molecular FormulaC12H9BrO4
  • Average mass297.102 Da
  • Monoisotopic mass295.968414 Da
  • ChemSpider ID44254331

More details:

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

105837-04-5 [RN]
2H-1-Benzopyran-3-carboxylic acid, 7-bromo-2-oxo-, ethyl ester [ACD/Index Name]
7-Bromo-2-oxo-2H-chromène-3-carboxylate d'éthyle [French] [ACD/IUPAC Name]
Ethyl 7-bromo-2-oxo-2H-chromene-3-carboxylate [ACD/IUPAC Name]
Ethyl 7-bromo-2-oxochromene-3-carboxylate
Ethyl-7-brom-2-oxo-2H-chromen-3-carboxylat [German] [ACD/IUPAC Name]
MFCD22373079

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

    Density: 1.6±0.1 g/cm3
    Boiling Point: 416.0±45.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.0 mmHg at 25°C
    Enthalpy of Vaporization: 66.9±3.0 kJ/mol
    Flash Point: 205.4±28.7 °C
    Index of Refraction: 1.595
    Molar Refractivity: 63.0±0.3 cm3
    #H bond acceptors: 4
    #H bond donors: 0
    #Freely Rotating Bonds: 3
    #Rule of 5 Violations: 0
    ACD/LogP: 2.93
    ACD/LogD (pH 5.5): 3.22
    ACD/BCF (pH 5.5): 163.62
    ACD/KOC (pH 5.5): 1337.45
    ACD/LogD (pH 7.4): 3.22
    ACD/BCF (pH 7.4): 163.62
    ACD/KOC (pH 7.4): 1337.45
    Polar Surface Area: 53 Å2
    Polarizability: 25.0±0.5 10-24cm3
    Surface Tension: 52.4±3.0 dyne/cm
    Molar Volume: 185.4±3.0 cm3

    Click to predict properties on the Chemicalize site


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