ChemSpider 2D Image | 3-(1,3-Dioxolan-2-yl)-2-thiophenecarboxylic acid | C8H8O4S

3-(1,3-Dioxolan-2-yl)-2-thiophenecarboxylic acid

  • Molecular FormulaC8H8O4S
  • Average mass200.212 Da
  • Monoisotopic mass200.014328 Da
  • ChemSpider ID21472872

More details:

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

2-Thiophenecarboxylic acid, 3-(1,3-dioxolan-2-yl)- [ACD/Index Name]
3-(1,3-Dioxolan-2-yl)-2-thiophencarbonsäure [German] [ACD/IUPAC Name]
3-(1,3-Dioxolan-2-yl)-2-thiophenecarboxylic acid [ACD/IUPAC Name]
934570-44-2 [RN]
Acide 3-(1,3-dioxolan-2-yl)-2-thiophènecarboxylique [French] [ACD/IUPAC Name]
[934570-44-2] [RN]
2-(2-Carboxythien-3-yl)-1,3-dioxolane
3-(1,3-Dioxolan-2-yl)-2-thiophenecarboxylicacid
3-(1,3-dioxolan-2-yl)thiophene-2-carboxylic acid
3-(1,3-Dioxolan-2-yl)thiophene-2-carboxylicacid
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.5±0.1 g/cm3
    Boiling Point: 352.1±42.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.8 mmHg at 25°C
    Enthalpy of Vaporization: 63.0±3.0 kJ/mol
    Flash Point: 166.8±27.9 °C
    Index of Refraction: 1.599
    Molar Refractivity: 46.8±0.3 cm3
    #H bond acceptors: 4
    #H bond donors: 1
    #Freely Rotating Bonds: 2
    #Rule of 5 Violations: 0
    ACD/LogP: 0.98
    ACD/LogD (pH 5.5): -0.62
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 1.30
    ACD/LogD (pH 7.4): -1.68
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 84 Å2
    Polarizability: 18.6±0.5 10-24cm3
    Surface Tension: 64.4±3.0 dyne/cm
    Molar Volume: 137.0±3.0 cm3

    Click to predict properties on the Chemicalize site


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