ChemSpider 2D Image | 4-Chloro-6-ethoxy-2-(methylthio)pyrimidine | C7H9ClN2OS

4-Chloro-6-ethoxy-2-(methylthio)pyrimidine

  • Molecular FormulaC7H9ClN2OS
  • Average mass204.677 Da
  • Monoisotopic mass204.012405 Da
  • ChemSpider ID26944036

More details:

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

221679-84-1 [RN]
4-Chlor-6-ethoxy-2-(methylsulfanyl)pyrimidin [German] [ACD/IUPAC Name]
4-Chloro-6-ethoxy-2-(methylsulfanyl)pyrimidine [ACD/IUPAC Name]
4-Chloro-6-éthoxy-2-(méthylsulfanyl)pyrimidine [French] [ACD/IUPAC Name]
4-Chloro-6-ethoxy-2-(methylthio)pyrimidine
Pyrimidine, 4-chloro-6-ethoxy-2-(methylthio)- [ACD/Index Name]
3-Phenyl-1,7a-dihydropyrrolo[1,2-c]oxazol-5(3H)-one
4-Chloro-6-ethoxy-2-methylsulfanylpyrimidine
4-Chloro-6-ethoxy-2-methylsulfanyl-pyrimidine
GS-6251
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

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

    Density: 1.3±0.1 g/cm3
    Boiling Point: 302.2±22.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.6 mmHg at 25°C
    Enthalpy of Vaporization: 52.1±3.0 kJ/mol
    Flash Point: 136.6±22.3 °C
    Index of Refraction: 1.564
    Molar Refractivity: 50.8±0.4 cm3
    #H bond acceptors: 3
    #H bond donors: 0
    #Freely Rotating Bonds: 3
    #Rule of 5 Violations: 0
    ACD/LogP: 3.40
    ACD/LogD (pH 5.5): 2.58
    ACD/BCF (pH 5.5): 54.15
    ACD/KOC (pH 5.5): 606.04
    ACD/LogD (pH 7.4): 2.58
    ACD/BCF (pH 7.4): 54.15
    ACD/KOC (pH 7.4): 606.04
    Polar Surface Area: 60 Å2
    Polarizability: 20.1±0.5 10-24cm3
    Surface Tension: 53.8±5.0 dyne/cm
    Molar Volume: 156.2±5.0 cm3

    Click to predict properties on the Chemicalize site


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