ChemSpider 2D Image | 5-Bromo-2-methoxyphenyl benzenesulfonate | C13H11BrO4S

5-Bromo-2-methoxyphenyl benzenesulfonate

  • Molecular FormulaC13H11BrO4S
  • Average mass343.193 Da
  • Monoisotopic mass341.956146 Da
  • ChemSpider ID25949379

More details:

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

5-Brom-2-methoxyphenyl-benzolsulfonat [German] [ACD/IUPAC Name]
5-Bromo-2-methoxyphenyl benzenesulfonate [ACD/IUPAC Name]
Benzènesulfonate de 5-bromo-2-méthoxyphényle [French] [ACD/IUPAC Name]
Phenol, 5-bromo-2-methoxy-, benzenesulfonate [ACD/Index Name]
[1150271-32-1] [RN]
1150271-32-1 [RN]
5-Bromo-2-methoxyphenylbenzenesulfonate
MFCD12026063
OT-0861

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

    Density: 1.5±0.1 g/cm3
    Boiling Point: 463.8±45.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.1 mmHg at 25°C
    Enthalpy of Vaporization: 69.7±3.0 kJ/mol
    Flash Point: 234.3±28.7 °C
    Index of Refraction: 1.597
    Molar Refractivity: 76.1±0.4 cm3
    #H bond acceptors: 4
    #H bond donors: 0
    #Freely Rotating Bonds: 4
    #Rule of 5 Violations: 0
    ACD/LogP: 3.79
    ACD/LogD (pH 5.5): 3.52
    ACD/BCF (pH 5.5): 278.19
    ACD/KOC (pH 5.5): 1955.53
    ACD/LogD (pH 7.4): 3.52
    ACD/BCF (pH 7.4): 278.19
    ACD/KOC (pH 7.4): 1955.53
    Polar Surface Area: 61 Å2
    Polarizability: 30.2±0.5 10-24cm3
    Surface Tension: 47.8±3.0 dyne/cm
    Molar Volume: 223.3±3.0 cm3

    Click to predict properties on the Chemicalize site


    Advertisement