ChemSpider 2D Image | 6-(1-Ethyl-3-methyl-1H-pyrazol-4-yl)-3-isopropyl[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole | C12H16N6S

6-(1-Ethyl-3-methyl-1H-pyrazol-4-yl)-3-isopropyl[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole

  • Molecular FormulaC12H16N6S
  • Average mass276.361 Da
  • Monoisotopic mass276.115723 Da
  • ChemSpider ID26037326

More details:

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

1,2,4-Triazolo[3,4-b][1,3,4]thiadiazole, 6-(1-ethyl-3-methyl-1H-pyrazol-4-yl)-3-(1-methylethyl)- [ACD/Index Name]
6-(1-Ethyl-3-methyl-1H-pyrazol-4-yl)-3-isopropyl[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol [German] [ACD/IUPAC Name]
6-(1-Ethyl-3-methyl-1H-pyrazol-4-yl)-3-isopropyl[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole [ACD/IUPAC Name]
6-(1-Éthyl-3-méthyl-1H-pyrazol-4-yl)-3-isopropyl[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole [French] [ACD/IUPAC Name]
1232809-01-6 [RN]
6-(1-ethyl-3-methyl-1H-pyrazol-4-yl)-3-(propan-2-yl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
6-(1-Ethyl-3-methyl-1H-pyrazol-4-yl)-3-isopropyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
6-(1-ethyl-3-methylpyrazol-4-yl)-3-propan-2-yl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole

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

    Density: 1.4±0.1 g/cm3
    Boiling Point:
    Vapour Pressure:
    Enthalpy of Vaporization:
    Flash Point:
    Index of Refraction: 1.741
    Molar Refractivity: 77.4±0.5 cm3
    #H bond acceptors: 6
    #H bond donors: 0
    #Freely Rotating Bonds: 3
    #Rule of 5 Violations: 0
    ACD/LogP: 2.95
    ACD/LogD (pH 5.5): 2.41
    ACD/BCF (pH 5.5): 39.78
    ACD/KOC (pH 5.5): 486.00
    ACD/LogD (pH 7.4): 2.41
    ACD/BCF (pH 7.4): 39.78
    ACD/KOC (pH 7.4): 486.00
    Polar Surface Area: 89 Å2
    Polarizability: 30.7±0.5 10-24cm3
    Surface Tension: 54.1±7.0 dyne/cm
    Molar Volume: 191.8±7.0 cm3

    Click to predict properties on the Chemicalize site


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