ChemSpider 2D Image | 5-[2-(2,3-Dihydro-1H-indol-1-yl)ethyl]-1,3,4-thiadiazol-2-amine | C12H14N4S

5-[2-(2,3-Dihydro-1H-indol-1-yl)ethyl]-1,3,4-thiadiazol-2-amine

  • Molecular FormulaC12H14N4S
  • Average mass246.331 Da
  • Monoisotopic mass246.093918 Da
  • ChemSpider ID21784128

More details:






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

1,3,4-thiadiazol-2-amine, 5-[2-(2,3-dihydro-1H-indol-1-yl)ethyl]-
5-[2-(2,3-Dihydro-1H-indol-1-yl)ethyl]-1,3,4-thiadiazol-2-amin [German] [ACD/IUPAC Name]
5-[2-(2,3-Dihydro-1H-indol-1-yl)ethyl]-1,3,4-thiadiazol-2-amine
5-[2-(2,3-Dihydro-1H-indol-1-yl)éthyl]-1,3,4-thiadiazol-2-amine [French] [ACD/IUPAC Name]
1019111-89-7 [RN]
5-[2-(2,3-dihydroindol-1-yl)ethyl]-1,3,4-thiadiazol-2-amine
AGN-PC-0653PU
AKOS005207769
F2169-1194
MFCD09965824
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.3±0.1 g/cm3
    Boiling Point: 469.1±47.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.2 mmHg at 25°C
    Enthalpy of Vaporization: 73.1±3.0 kJ/mol
    Flash Point: 237.5±29.3 °C
    Index of Refraction: 1.676
    Molar Refractivity: 70.0±0.3 cm3
    #H bond acceptors: 4
    #H bond donors: 2
    #Freely Rotating Bonds: 3
    #Rule of 5 Violations: 0
    ACD/LogP: 1.79
    ACD/LogD (pH 5.5): 1.38
    ACD/BCF (pH 5.5): 4.90
    ACD/KOC (pH 5.5): 76.73
    ACD/LogD (pH 7.4): 1.90
    ACD/BCF (pH 7.4): 16.14
    ACD/KOC (pH 7.4): 252.68
    Polar Surface Area: 83 Å2
    Polarizability: 27.8±0.5 10-24cm3
    Surface Tension: 69.2±3.0 dyne/cm
    Molar Volume: 186.1±3.0 cm3

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