ChemSpider 2D Image | 3-Bromo-5-(methylsulfinyl)pyridine | C6H6BrNOS

3-Bromo-5-(methylsulfinyl)pyridine

  • Molecular FormulaC6H6BrNOS
  • Average mass220.087 Da
  • Monoisotopic mass218.935333 Da
  • ChemSpider ID58189102

More details:

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

3-Brom-5-(methylsulfinyl)pyridin [German] [ACD/IUPAC Name]
3-Bromo-5-(methylsulfinyl)pyridine [ACD/IUPAC Name]
3-Bromo-5-(méthylsulfinyl)pyridine [French] [ACD/IUPAC Name]
Pyridine, 3-bromo-5-(methylsulfinyl)- [ACD/Index Name]
1193245-15-6 [RN]
MFCD28402471

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

    Density: 1.8±0.1 g/cm3
    Boiling Point: 351.7±27.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.7 mmHg at 25°C
    Enthalpy of Vaporization: 57.3±3.0 kJ/mol
    Flash Point: 166.5±23.7 °C
    Index of Refraction: 1.668
    Molar Refractivity: 45.8±0.4 cm3
    #H bond acceptors: 2
    #H bond donors: 0
    #Freely Rotating Bonds: 1
    #Rule of 5 Violations: 0
    ACD/LogP: 0.08
    ACD/LogD (pH 5.5): 1.02
    ACD/BCF (pH 5.5): 3.50
    ACD/KOC (pH 5.5): 85.31
    ACD/LogD (pH 7.4): 1.02
    ACD/BCF (pH 7.4): 3.50
    ACD/KOC (pH 7.4): 85.31
    Polar Surface Area: 49 Å2
    Polarizability: 18.1±0.5 10-24cm3
    Surface Tension: 76.4±5.0 dyne/cm
    Molar Volume: 122.9±5.0 cm3

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