ChemSpider 2D Image | 3-Methyl-5-[(2-methyl-2-propanyl)sulfanyl]-2-(methylsulfanyl)pyridine | C11H17NS2

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

  • Molecular FormulaC11H17NS2
  • Average mass227.389 Da
  • Monoisotopic mass227.080246 Da
  • ChemSpider ID35481371

More details:

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

3-Methyl-5-[(2-methyl-2-propanyl)sulfanyl]-2-(methylsulfanyl)pyridin [German] [ACD/IUPAC Name]
3-Methyl-5-[(2-methyl-2-propanyl)sulfanyl]-2-(methylsulfanyl)pyridine [ACD/IUPAC Name]
3-Méthyl-5-[(2-méthyl-2-propanyl)sulfanyl]-2-(méthylsulfanyl)pyridine [French] [ACD/IUPAC Name]
Pyridine, 5-[(1,1-dimethylethyl)thio]-3-methyl-2-(methylthio)- [ACD/Index Name]
1355215-63-2 [RN]
5-tert-butylsulfanyl-3-methyl-2-methylsulfanylpyridine
5-tert-Butylsulfanyl-3-methyl-2-methylsulfanyl-pyridine
MFCD21087253

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

    Density: 1.1±0.1 g/cm3
    Boiling Point: 322.9±42.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.7 mmHg at 25°C
    Enthalpy of Vaporization: 54.2±3.0 kJ/mol
    Flash Point: 149.1±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): 1670.60
    ACD/KOC (pH 5.5): 7051.79
    ACD/LogD (pH 7.4): 4.54
    ACD/BCF (pH 7.4): 1673.70
    ACD/KOC (pH 7.4): 7064.85
    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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