ChemSpider 2D Image | Thieno[2,3-b]furan-5-carboxylic acid | C7H4O3S

Thieno[2,3-b]furan-5-carboxylic acid

  • Molecular FormulaC7H4O3S
  • Average mass168.170 Da
  • Monoisotopic mass167.988113 Da
  • ChemSpider ID27258825

More details:

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

Acide thiéno[2,3-b]furane-5-carboxylique [French] [ACD/IUPAC Name]
Thieno[2,3-b]furan-5-carbonsäure [German] [ACD/IUPAC Name]
Thieno[2,3-b]furan-5-carboxylic acid [ACD/Index Name] [ACD/IUPAC Name]
934246-40-9 [RN]
MFCD20657776

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

    Density: 1.6±0.1 g/cm3
    Boiling Point: 334.8±22.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.8 mmHg at 25°C
    Enthalpy of Vaporization: 61.0±3.0 kJ/mol
    Flash Point: 156.3±22.3 °C
    Index of Refraction: 1.696
    Molar Refractivity: 41.7±0.3 cm3
    #H bond acceptors: 3
    #H bond donors: 1
    #Freely Rotating Bonds: 1
    #Rule of 5 Violations: 0
    ACD/LogP: 3.20
    ACD/LogD (pH 5.5): 0.55
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 5.12
    ACD/LogD (pH 7.4): -0.43
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 79 Å2
    Polarizability: 16.5±0.5 10-24cm3
    Surface Tension: 67.3±3.0 dyne/cm
    Molar Volume: 108.4±3.0 cm3

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