ChemSpider 2D Image | 3-Thietanamine 1,1-dioxide | C3H7NO2S

3-Thietanamine 1,1-dioxide

  • Molecular FormulaC3H7NO2S
  • Average mass121.158 Da
  • Monoisotopic mass121.019745 Da
  • ChemSpider ID29784273

More details:

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

1,1-Dioxyde de -3-thiétanamine [French] [ACD/IUPAC Name]
3-amino-1??-thietane-1,1-dione
3-Thietanamin-1,1-dioxid [German] [ACD/IUPAC Name]
3-Thietanamine 1,1-dioxide [ACD/IUPAC Name]
3-Thietanamine, 1,1-dioxide [ACD/Index Name]
88511-13-1 [RN]
(1,1-Dioxido-3-thietanyl)amine
(2,6-Dichloropyridin-4-yl)methanamine hydrochloride
1,1-Dioxo-1l6-thietan-3-ylamine
1,1-dioxothietan-3-amine
More...

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

    Density: 1.4±0.1 g/cm3
    Boiling Point: 336.9±35.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.7 mmHg at 25°C
    Enthalpy of Vaporization: 58.0±3.0 kJ/mol
    Flash Point: 157.5±25.9 °C
    Index of Refraction: 1.530
    Molar Refractivity: 26.3±0.4 cm3
    #H bond acceptors: 3
    #H bond donors: 2
    #Freely Rotating Bonds: 0
    #Rule of 5 Violations: 0
    ACD/LogP: -2.12
    ACD/LogD (pH 5.5): -1.92
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 2.14
    ACD/LogD (pH 7.4): -1.91
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 2.16
    Polar Surface Area: 69 Å2
    Polarizability: 10.4±0.5 10-24cm3
    Surface Tension: 46.8±3.0 dyne/cm
    Molar Volume: 85.1±3.0 cm3

    Click to predict properties on the Chemicalize site


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