ChemSpider 2D Image | 2-[Difluoro(phenylsulfanyl)methyl]-5-methyl-1,3,4-oxadiazole | C10H8F2N2OS

2-[Difluoro(phenylsulfanyl)methyl]-5-methyl-1,3,4-oxadiazole

  • Molecular FormulaC10H8F2N2OS
  • Average mass242.245 Da
  • Monoisotopic mass242.032532 Da
  • ChemSpider ID35486756

More details:

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

1,3,4-Oxadiazole, 2-[difluoro(phenylthio)methyl]-5-methyl- [ACD/Index Name]
2-[Difluor(phenylsulfanyl)methyl]-5-methyl-1,3,4-oxadiazol [German] [ACD/IUPAC Name]
2-[Difluoro(phenylsulfanyl)methyl]-5-methyl-1,3,4-oxadiazole [ACD/IUPAC Name]
2-[Difluoro(phénylsulfanyl)méthyl]-5-méthyl-1,3,4-oxadiazole [French] [ACD/IUPAC Name]
1403567-67-8 [RN]
2-(Difluoro-phenylsulfanyl-methyl)-5-methyl-[1,3,4]oxadiazole
MFCD22548891

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

    Density: 1.4±0.1 g/cm3
    Boiling Point: 277.0±50.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.5 mmHg at 25°C
    Enthalpy of Vaporization: 49.5±3.0 kJ/mol
    Flash Point: 121.3±30.1 °C
    Index of Refraction: 1.563
    Molar Refractivity: 57.1±0.4 cm3
    #H bond acceptors: 3
    #H bond donors: 0
    #Freely Rotating Bonds: 3
    #Rule of 5 Violations: 0
    ACD/LogP: 3.51
    ACD/LogD (pH 5.5): 2.74
    ACD/BCF (pH 5.5): 71.71
    ACD/KOC (pH 5.5): 741.06
    ACD/LogD (pH 7.4): 2.74
    ACD/BCF (pH 7.4): 71.71
    ACD/KOC (pH 7.4): 741.06
    Polar Surface Area: 64 Å2
    Polarizability: 22.6±0.5 10-24cm3
    Surface Tension: 50.9±5.0 dyne/cm
    Molar Volume: 175.6±5.0 cm3

    Click to predict properties on the Chemicalize site


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