Found 822 results

Search term: MF = 'C_{13}H_{13}FN_{4}S'
ChemSpider 2D Image | 3-Butyl-6-(2-fluorophenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole | C13H13FN4S

3-Butyl-6-(2-fluorophenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole

  • Molecular FormulaC13H13FN4S
  • Average mass276.332 Da
  • Monoisotopic mass276.084503 Da
  • ChemSpider ID21634267

More details:

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

1,2,4-Triazolo[3,4-b][1,3,4]thiadiazole, 3-butyl-6-(2-fluorophenyl)- [ACD/Index Name]
3-Butyl-6-(2-fluorophenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole [ACD/IUPAC Name]
3-Butyl-6-(2-fluorophényl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole [French] [ACD/IUPAC Name]
3-Butyl-6-(2-fluorphenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol [German] [ACD/IUPAC Name]
3-butyl-6-(2-fluorophenyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
947039-82-9 [RN]
AGN-PC-063JDD
AO-365/43400976
MCULE-3238976635
MolPort-008-385-030
More...

    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: 1.688
    Molar Refractivity: 75.4±0.5 cm3
    #H bond acceptors: 4
    #H bond donors: 0
    #Freely Rotating Bonds: 4
    #Rule of 5 Violations: 0
    ACD/LogP: 3.94
    ACD/LogD (pH 5.5): 3.33
    ACD/BCF (pH 5.5): 199.94
    ACD/KOC (pH 5.5): 1543.82
    ACD/LogD (pH 7.4): 3.33
    ACD/BCF (pH 7.4): 199.94
    ACD/KOC (pH 7.4): 1543.82
    Polar Surface Area: 71 Å2
    Polarizability: 29.9±0.5 10-24cm3
    Surface Tension: 50.5±7.0 dyne/cm
    Molar Volume: 197.9±7.0 cm3

    Click to predict properties on the Chemicalize site


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