ChemSpider 2D Image | 4-(Cycloheptylamino)tetrahydro-3-thiopheneol 1,1-dioxide | C11H21NO3S

4-(Cycloheptylamino)tetrahydro-3-thiopheneol 1,1-dioxide

  • Molecular FormulaC11H21NO3S
  • Average mass247.354 Da
  • Monoisotopic mass247.124207 Da
  • ChemSpider ID26046150

More details:

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

1,1-Dioxyde de 4-(cycloheptylamino)tétrahydro-3-thiophèneol [French] [ACD/IUPAC Name]
3-Thiopheneol, 4-(cycloheptylamino)tetrahydro-, 1,1-dioxide [ACD/Index Name]
4-(Cycloheptylamino)tetrahydro-3-thiopheneol 1,1-dioxide [ACD/IUPAC Name]
4-(Cycloheptylamino)tetrahydro-3-thiophenol-1,1-dioxid [German] [ACD/IUPAC Name]
1183784-35-1 [RN]
4-(cycloheptylamino)-1,1-dioxothiolan-3-ol
4-(cycloheptylamino)tetrahydrothiophene-3-ol 1,1-dioxide

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

    Density: 1.2±0.1 g/cm3
    Boiling Point: 467.4±45.0 °C at 760 mmHg
    Vapour Pressure: 0.0±2.6 mmHg at 25°C
    Enthalpy of Vaporization: 84.1±6.0 kJ/mol
    Flash Point: 236.5±28.7 °C
    Index of Refraction: 1.542
    Molar Refractivity: 62.8±0.4 cm3
    #H bond acceptors: 4
    #H bond donors: 2
    #Freely Rotating Bonds: 2
    #Rule of 5 Violations: 0
    ACD/LogP: 0.49
    ACD/LogD (pH 5.5): -0.87
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 1.60
    ACD/LogD (pH 7.4): 0.51
    ACD/BCF (pH 7.4): 1.33
    ACD/KOC (pH 7.4): 38.53
    Polar Surface Area: 75 Å2
    Polarizability: 24.9±0.5 10-24cm3
    Surface Tension: 49.7±5.0 dyne/cm
    Molar Volume: 199.8±5.0 cm3

    Click to predict properties on the Chemicalize site


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