ChemSpider 2D Image | 3-Chloro-2-(methylsulfanyl)pyridine | C6H6ClNS

3-Chloro-2-(methylsulfanyl)pyridine

  • Molecular FormulaC6H6ClNS
  • Average mass159.637 Da
  • Monoisotopic mass158.990952 Da
  • ChemSpider ID14887065

More details:

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

3-Chlor-2-(methylsulfanyl)pyridin [German] [ACD/IUPAC Name]
3-Chloro-2-(methylsulfanyl)pyridine [ACD/IUPAC Name]
3-Chloro-2-(méthylsulfanyl)pyridine [French] [ACD/IUPAC Name]
97936-43-1 [RN]
98626-97-2 [RN]
Pyridine, 3-chloro-2-(methylthio)- [ACD/Index Name]
[98626-97-2] [RN]
2-(METHYLTHIO)NICOTINYL CHLORIDE
2-Methylthio-3-chloropyridine
3-Chloro-2-(methylthio)pyridine
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.3±0.1 g/cm3
    Boiling Point: 228.2±25.0 °C at 760 mmHg
    Vapour Pressure: 0.1±0.4 mmHg at 25°C
    Enthalpy of Vaporization: 44.6±3.0 kJ/mol
    Flash Point: 91.8±23.2 °C
    Index of Refraction: 1.591
    Molar Refractivity: 42.0±0.4 cm3
    #H bond acceptors: 1
    #H bond donors: 0
    #Freely Rotating Bonds: 1
    #Rule of 5 Violations: 0
    ACD/LogP: 2.72
    ACD/LogD (pH 5.5): 2.41
    ACD/BCF (pH 5.5): 40.27
    ACD/KOC (pH 5.5): 490.30
    ACD/LogD (pH 7.4): 2.41
    ACD/BCF (pH 7.4): 40.28
    ACD/KOC (pH 7.4): 490.34
    Polar Surface Area: 38 Å2
    Polarizability: 16.7±0.5 10-24cm3
    Surface Tension: 48.8±5.0 dyne/cm
    Molar Volume: 124.4±5.0 cm3

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