ChemSpider 2D Image | 2-Bromo-4-formylbenzoic acid | C8H5BrO3

2-Bromo-4-formylbenzoic acid

  • Molecular FormulaC8H5BrO3
  • Average mass229.027 Da
  • Monoisotopic mass227.942200 Da
  • ChemSpider ID32702777

More details:

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

2-Brom-4-formylbenzoesäure [German] [ACD/IUPAC Name]
2-Bromo-4-formylbenzoic acid [ACD/IUPAC Name]
90001-44-8 [RN]
Acide 2-bromo-4-formylbenzoïque [French] [ACD/IUPAC Name]
Benzoic acid, 2-bromo-4-formyl- [ACD/Index Name]
MFCD26855789

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

    Density: 1.8±0.1 g/cm3
    Boiling Point: 367.1±32.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.9 mmHg at 25°C
    Enthalpy of Vaporization: 64.7±3.0 kJ/mol
    Flash Point: 175.8±25.1 °C
    Index of Refraction: 1.655
    Molar Refractivity: 47.6±0.3 cm3
    #H bond acceptors: 3
    #H bond donors: 1
    #Freely Rotating Bonds: 2
    #Rule of 5 Violations: 0
    ACD/LogP: 2.11
    ACD/LogD (pH 5.5): -0.49
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 1.00
    ACD/LogD (pH 7.4): -0.82
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 54 Å2
    Polarizability: 18.9±0.5 10-24cm3
    Surface Tension: 62.5±3.0 dyne/cm
    Molar Volume: 129.8±3.0 cm3

    Click to predict properties on the Chemicalize site


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