ChemSpider 2D Image | Ethyl tetrahydro-2H-thiopyran-4-carboxylate 1,1-dioxide | C8H14O4S

Ethyl tetrahydro-2H-thiopyran-4-carboxylate 1,1-dioxide

  • Molecular FormulaC8H14O4S
  • Average mass206.259 Da
  • Monoisotopic mass206.061279 Da
  • ChemSpider ID35328987

More details:

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

1,1-Dioxyde de tétrahydro-2H-thiopyrane-4-carboxylate d'éthyle [French] [ACD/IUPAC Name]
2H-Thiopyran-4-carboxylic acid, tetrahydro-, ethyl ester, 1,1-dioxide [ACD/Index Name]
Ethyl tetrahydro-2H-thiopyran-4-carboxylate 1,1-dioxide [ACD/IUPAC Name]
Ethyl-tetrahydro-2H-thiopyran-4-carboxylat-1,1-dioxid [German] [ACD/IUPAC Name]
1779126-20-3 [RN]
Ethyl 1,1-dioxo-1λ(6)-thiane-4-carboxylate
KS-8577
MFCD20259109

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

    Density: 1.2±0.1 g/cm3
    Boiling Point: 359.4±35.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.8 mmHg at 25°C
    Enthalpy of Vaporization: 60.5±3.0 kJ/mol
    Flash Point: 171.1±25.9 °C
    Index of Refraction: 1.483
    Molar Refractivity: 47.7±0.4 cm3
    #H bond acceptors: 4
    #H bond donors: 0
    #Freely Rotating Bonds: 3
    #Rule of 5 Violations: 0
    ACD/LogP: -0.06
    ACD/LogD (pH 5.5): 0.10
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 26.98
    ACD/LogD (pH 7.4): 0.10
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 26.98
    Polar Surface Area: 69 Å2
    Polarizability: 18.9±0.5 10-24cm3
    Surface Tension: 41.4±3.0 dyne/cm
    Molar Volume: 167.1±3.0 cm3

    Click to predict properties on the Chemicalize site


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