Found 41 results

Search term: MF = 'C_{6}H_{5}BrO_{3}S'
ChemSpider 2D Image | 5-Bromo-3-hydroxy-4-methyl-2-thiophenecarboxylic acid | C6H5BrO3S

5-Bromo-3-hydroxy-4-methyl-2-thiophenecarboxylic acid

  • Molecular FormulaC6H5BrO3S
  • Average mass237.071 Da
  • Monoisotopic mass235.914276 Da
  • ChemSpider ID37651311

More details:

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

2-Thiophenecarboxylic acid, 5-bromo-3-hydroxy-4-methyl- [ACD/Index Name]
5-Brom-3-hydroxy-4-methyl-2-thiophencarbonsäure [German] [ACD/IUPAC Name]
5-Bromo-3-hydroxy-4-methyl-2-thiophenecarboxylic acid [ACD/IUPAC Name]
Acide 5-bromo-3-hydroxy-4-méthyl-2-thiophènecarboxylique [French] [ACD/IUPAC Name]
1501933-66-9 [RN]
5-bromo-3-hydroxy-4-methylthiophene-2-carboxylic acid
MFCD30003081

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

    Density: 1.9±0.1 g/cm3
    Boiling Point: 343.2±42.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.8 mmHg at 25°C
    Enthalpy of Vaporization: 62.0±3.0 kJ/mol
    Flash Point: 161.3±27.9 °C
    Index of Refraction: 1.675
    Molar Refractivity: 46.0±0.3 cm3
    #H bond acceptors: 3
    #H bond donors: 2
    #Freely Rotating Bonds: 1
    #Rule of 5 Violations: 0
    ACD/LogP: 3.47
    ACD/LogD (pH 5.5): 0.77
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 4.04
    ACD/LogD (pH 7.4): 0.23
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.19
    Polar Surface Area: 86 Å2
    Polarizability: 18.2±0.5 10-24cm3
    Surface Tension: 71.5±3.0 dyne/cm
    Molar Volume: 122.3±3.0 cm3

    Click to predict properties on the Chemicalize site


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