ChemSpider 2D Image | 4-Methyl-5-[(2-methyl-2-propanyl)sulfanyl]-2-(methylsulfanyl)pyridine | C11H17NS2

4-Methyl-5-[(2-methyl-2-propanyl)sulfanyl]-2-(methylsulfanyl)pyridine

  • Molecular FormulaC11H17NS2
  • Average mass227.389 Da
  • Monoisotopic mass227.080246 Da
  • ChemSpider ID35482136

More details:

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

4-Methyl-5-[(2-methyl-2-propanyl)sulfanyl]-2-(methylsulfanyl)pyridin [German] [ACD/IUPAC Name]
4-Methyl-5-[(2-methyl-2-propanyl)sulfanyl]-2-(methylsulfanyl)pyridine [ACD/IUPAC Name]
4-Méthyl-5-[(2-méthyl-2-propanyl)sulfanyl]-2-(méthylsulfanyl)pyridine [French] [ACD/IUPAC Name]
Pyridine, 5-[(1,1-dimethylethyl)thio]-4-methyl-2-(methylthio)- [ACD/Index Name]
1355222-81-9 [RN]
5-tert-butylsulfanyl-4-methyl-2-methylsulfanylpyridine
5-tert-Butylsulfanyl-4-methyl-2-methylsulfanyl-pyridine
MFCD21088032

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

    Density: 1.1±0.1 g/cm3
    Boiling Point: 324.8±42.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.7 mmHg at 25°C
    Enthalpy of Vaporization: 54.4±3.0 kJ/mol
    Flash Point: 150.2±27.9 °C
    Index of Refraction: 1.567
    Molar Refractivity: 68.4±0.4 cm3
    #H bond acceptors: 1
    #H bond donors: 0
    #Freely Rotating Bonds: 3
    #Rule of 5 Violations: 0
    ACD/LogP: 4.44
    ACD/LogD (pH 5.5): 4.54
    ACD/BCF (pH 5.5): 1666.52
    ACD/KOC (pH 5.5): 7034.55
    ACD/LogD (pH 7.4): 4.54
    ACD/BCF (pH 7.4): 1673.65
    ACD/KOC (pH 7.4): 7064.64
    Polar Surface Area: 63 Å2
    Polarizability: 27.1±0.5 10-24cm3
    Surface Tension: 43.4±5.0 dyne/cm
    Molar Volume: 209.2±5.0 cm3

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