ChemSpider 2D Image | 5,6-Dihydro-4H-thieno[2,3-c]pyrrol-4-one | C6H5NOS

5,6-Dihydro-4H-thieno[2,3-c]pyrrol-4-one

  • Molecular FormulaC6H5NOS
  • Average mass139.175 Da
  • Monoisotopic mass139.009186 Da
  • ChemSpider ID51101072

More details:

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

4H-Thieno[2,3-c]pyrrol-4-one, 5,6-dihydro- [ACD/Index Name]
5,6-Dihydro-4H-thieno[2,3-c]pyrrol-4-on [German] [ACD/IUPAC Name]
5,6-Dihydro-4H-thieno[2,3-c]pyrrol-4-one [ACD/IUPAC Name]
5,6-Dihydro-4H-thiéno[2,3-c]pyrrol-4-one [French] [ACD/IUPAC Name]
1078149-76-4 [RN]
MFCD24848357

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

    Density: 1.4±0.1 g/cm3
    Boiling Point: 415.4±34.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.0 mmHg at 25°C
    Enthalpy of Vaporization: 66.8±3.0 kJ/mol
    Flash Point: 205.0±25.7 °C
    Index of Refraction: 1.628
    Molar Refractivity: 35.7±0.3 cm3
    #H bond acceptors: 2
    #H bond donors: 1
    #Freely Rotating Bonds: 0
    #Rule of 5 Violations: 0
    ACD/LogP: 0.06
    ACD/LogD (pH 5.5): 0.69
    ACD/BCF (pH 5.5): 1.96
    ACD/KOC (pH 5.5): 56.35
    ACD/LogD (pH 7.4): 0.69
    ACD/BCF (pH 7.4): 1.96
    ACD/KOC (pH 7.4): 56.35
    Polar Surface Area: 57 Å2
    Polarizability: 14.1±0.5 10-24cm3
    Surface Tension: 52.6±3.0 dyne/cm
    Molar Volume: 100.5±3.0 cm3

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