ChemSpider 2D Image | 4H,6H,7H-thieno[3,2-c]pyran-2-carboxylic acid | C8H8O3S

4H,6H,7H-thieno[3,2-c]pyran-2-carboxylic acid

  • Molecular FormulaC8H8O3S
  • Average mass184.212 Da
  • Monoisotopic mass184.019409 Da
  • ChemSpider ID24582295

More details:

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

4H,6H,7H-thieno[3,2-c]pyran-2-carboxylic acid
4H-Thieno[3,2-c]pyran-2-carboxylic acid, 6,7-dihydro- [ACD/Index Name]
6,7-Dihydro-4H-thieno[3,2-c]pyran-2-carbonsäure [German] [ACD/IUPAC Name]
6,7-dihydro-4h-thieno-[3,2-c]pyran-2-carboxylic acid
6,7-Dihydro-4H-thieno[3,2-c]pyran-2-carboxylic acid [ACD/IUPAC Name]
933747-41-2 [RN]
Acide 6,7-dihydro-4H-thiéno[3,2-c]pyrane-2-carboxylique [French] [ACD/IUPAC Name]
MFCD12088019 [MDL number]
6,7-dihydro-4h-thieno[3,2-c]pyran-2-carboxylicacid

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

    Density: 1.4±0.1 g/cm3
    Boiling Point: 402.3±45.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.0 mmHg at 25°C
    Enthalpy of Vaporization: 68.9±3.0 kJ/mol
    Flash Point: 197.1±28.7 °C
    Index of Refraction: 1.619
    Molar Refractivity: 45.3±0.3 cm3
    #H bond acceptors: 3
    #H bond donors: 1
    #Freely Rotating Bonds: 1
    #Rule of 5 Violations: 0
    ACD/LogP: 1.41
    ACD/LogD (pH 5.5): 0.30
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 5.55
    ACD/LogD (pH 7.4): -0.99
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 75 Å2
    Polarizability: 18.0±0.5 10-24cm3
    Surface Tension: 62.4±3.0 dyne/cm
    Molar Volume: 129.3±3.0 cm3

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