ChemSpider 2D Image | 4-Bromo-5-methyl-2-furoic acid | C6H5BrO3

4-Bromo-5-methyl-2-furoic acid

  • Molecular FormulaC6H5BrO3
  • Average mass205.006 Da
  • Monoisotopic mass203.942200 Da
  • ChemSpider ID35486226

More details:

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

1399653-21-4 [RN]
2-Furancarboxylic acid, 4-bromo-5-methyl- [ACD/Index Name]
4-Brom-5-methyl-2-furoesäure [German] [ACD/IUPAC Name]
4-Bromo-5-methyl-2-furoic acid [ACD/IUPAC Name]
4-bromo-5-methylfuran-2-carboxylic acid
Acide 4-bromo-5-méthyl-2-furoïque [French] [ACD/IUPAC Name]
4-Bromo-5-methyl-furan-2-carboxylic acid
AGN-PC-0J37PQ
AKOS020008027
MFCD22421377
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.7±0.1 g/cm3
    Boiling Point: 285.9±40.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.6 mmHg at 25°C
    Enthalpy of Vaporization: 55.4±3.0 kJ/mol
    Flash Point: 126.7±27.3 °C
    Index of Refraction: 1.562
    Molar Refractivity: 38.0±0.3 cm3
    #H bond acceptors: 3
    #H bond donors: 1
    #Freely Rotating Bonds: 1
    #Rule of 5 Violations: 0
    ACD/LogP: 1.94
    ACD/LogD (pH 5.5): -0.16
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 1.76
    ACD/LogD (pH 7.4): -0.99
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 50 Å2
    Polarizability: 15.1±0.5 10-24cm3
    Surface Tension: 49.9±3.0 dyne/cm
    Molar Volume: 117.2±3.0 cm3

    Click to predict properties on the Chemicalize site


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