ChemSpider 2D Image | 2-Chloro-4-(ethylsulfanyl)-6-methylpyrimidine | C7H9ClN2S

2-Chloro-4-(ethylsulfanyl)-6-methylpyrimidine

  • Molecular FormulaC7H9ClN2S
  • Average mass188.678 Da
  • Monoisotopic mass188.017502 Da
  • ChemSpider ID40555072

More details:






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

2-Chlor-4-(ethylsulfanyl)-6-methylpyrimidin [German] [ACD/IUPAC Name]
2-Chloro-4-(ethylsulfanyl)-6-methylpyrimidine [ACD/IUPAC Name]
2-Chloro-4-(éthylsulfanyl)-6-méthylpyrimidine [French] [ACD/IUPAC Name]
Pyrimidine, 2-chloro-4-(ethylthio)-6-methyl- [ACD/Index Name]
89856-79-1 [RN]
MFCD16767390

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

    Density: 1.3±0.1 g/cm3
    Boiling Point: 304.6±22.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.6 mmHg at 25°C
    Enthalpy of Vaporization: 52.3±3.0 kJ/mol
    Flash Point: 138.0±22.3 °C
    Index of Refraction: 1.569
    Molar Refractivity: 49.1±0.4 cm3
    #H bond acceptors: 2
    #H bond donors: 0
    #Freely Rotating Bonds: 2
    #Rule of 5 Violations: 0
    ACD/LogP: 2.70
    ACD/LogD (pH 5.5): 2.32
    ACD/BCF (pH 5.5): 34.27
    ACD/KOC (pH 5.5): 436.82
    ACD/LogD (pH 7.4): 2.32
    ACD/BCF (pH 7.4): 34.27
    ACD/KOC (pH 7.4): 436.82
    Polar Surface Area: 51 Å2
    Polarizability: 19.5±0.5 10-24cm3
    Surface Tension: 52.1±5.0 dyne/cm
    Molar Volume: 149.9±5.0 cm3

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