ChemSpider 2D Image | 4,7-Diiodo-2,1,3-benzothiadiazole | C6H2I2N2S

4,7-Diiodo-2,1,3-benzothiadiazole

  • Molecular FormulaC6H2I2N2S
  • Average mass387.967 Da
  • Monoisotopic mass387.802795 Da
  • ChemSpider ID21134806

More details:

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

167281-18-7 [RN]
2,1,3-Benzothiadiazole, 4,7-diiodo- [ACD/Index Name]
4,7-Diiod-2,1,3-benzothiadiazol [German] [ACD/IUPAC Name]
4,7-Diiodo-2,1,3-benzothiadiazole [ACD/IUPAC Name]
4,7-Diiodo-2,1,3-benzothiadiazole [French] [ACD/IUPAC Name]
4,7-diiodobenzo[c][1,2,5]thiadiazole
MFCD14583013

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

    Density: 2.7±0.1 g/cm3
    Boiling Point: 378.3±22.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.8 mmHg at 25°C
    Enthalpy of Vaporization: 60.2±3.0 kJ/mol
    Flash Point: 182.6±22.3 °C
    Index of Refraction: 1.856
    Molar Refractivity: 64.5±0.3 cm3
    #H bond acceptors: 2
    #H bond donors: 0
    #Freely Rotating Bonds: 0
    #Rule of 5 Violations: 0
    ACD/LogP: 3.87
    ACD/LogD (pH 5.5): 3.64
    ACD/BCF (pH 5.5): 344.68
    ACD/KOC (pH 5.5): 2279.74
    ACD/LogD (pH 7.4): 3.64
    ACD/BCF (pH 7.4): 344.68
    ACD/KOC (pH 7.4): 2279.74
    Polar Surface Area: 54 Å2
    Polarizability: 25.6±0.5 10-24cm3
    Surface Tension: 83.2±3.0 dyne/cm
    Molar Volume: 143.6±3.0 cm3

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