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Search term: JRJNDYBSBGHCTB-ZHACJKMWSA-N (Found by InChIKey (full match))
ChemSpider 2D Image | 3-Butyl-6-[(E)-2-phenylvinyl][1,2,4]triazolo[3,4-b][1,3,4]thiadiazole | C15H16N4S

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

  • Molecular FormulaC15H16N4S
  • Average mass284.379 Da
  • Monoisotopic mass284.109558 Da
  • ChemSpider ID23048631

  • Double-bond stereo - Double-bond stereo

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-[(E)-2-phenylethenyl]- [ACD/Index Name]
3-Butyl-6-[(E)-2-phenylvinyl][1,2,4]triazolo[3,4-b][1,3,4]thiadiazol [German] [ACD/IUPAC Name]
3-Butyl-6-[(E)-2-phenylvinyl][1,2,4]triazolo[3,4-b][1,3,4]thiadiazole [ACD/IUPAC Name]
3-Butyl-6-[(E)-2-phénylvinyl][1,2,4]triazolo[3,4-b][1,3,4]thiadiazole [French] [ACD/IUPAC Name]
3-butyl-6-[(E)-2-phenylethenyl]-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
947944-02-7 [RN]

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

    Density: 1.3±0.1 g/cm3
    Boiling Point:
    Vapour Pressure:
    Enthalpy of Vaporization:
    Flash Point:
    Index of Refraction: 1.669
    Molar Refractivity: 84.8±0.5 cm3
    #H bond acceptors: 4
    #H bond donors: 0
    #Freely Rotating Bonds: 5
    #Rule of 5 Violations: 0
    ACD/LogP: 4.85
    ACD/LogD (pH 5.5): 3.67
    ACD/BCF (pH 5.5): 361.90
    ACD/KOC (pH 5.5): 2360.71
    ACD/LogD (pH 7.4): 3.67
    ACD/BCF (pH 7.4): 361.91
    ACD/KOC (pH 7.4): 2360.74
    Polar Surface Area: 71 Å2
    Polarizability: 33.6±0.5 10-24cm3
    Surface Tension: 50.2±7.0 dyne/cm
    Molar Volume: 227.1±7.0 cm3

    Click to predict properties on the Chemicalize site


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