Found 1 result

Search term: MNASLHKBLVRWNY (Found by InChIKey (skeleton match))
ChemSpider 2D Image | 7,9-Dimethyl-1,4-dithiaspiro[4.4]nonane-7-carboxylic acid | C10H16O2S2

7,9-Dimethyl-1,4-dithiaspiro[4.4]nonane-7-carboxylic acid

  • Molecular FormulaC10H16O2S2
  • Average mass232.363 Da
  • Monoisotopic mass232.059174 Da
  • ChemSpider ID35505167

More details:

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

1,4-Dithiaspiro[4.4]nonane-7-carboxylic acid, 7,9-dimethyl- [ACD/Index Name]
7,9-Dimethyl-1,4-dithiaspiro[4.4]nonan-7-carbonsäure [German] [ACD/IUPAC Name]
7,9-Dimethyl-1,4-dithiaspiro[4.4]nonane-7-carboxylic acid [ACD/IUPAC Name]
Acide 7,9-diméthyl-1,4-dithiaspiro[4.4]nonane-7-carboxylique [French] [ACD/IUPAC Name]
1823555-62-9 [RN]
7,9-Dimethyl-1,4-dithia-spiro[4.4]nonane-7-carboxylic acid
MFCD28146429

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

    Density: 1.3±0.1 g/cm3
    Boiling Point: 387.9±37.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.9 mmHg at 25°C
    Enthalpy of Vaporization: 69.9±6.0 kJ/mol
    Flash Point: 188.4±26.5 °C
    Index of Refraction: 1.601
    Molar Refractivity: 61.9±0.4 cm3
    #H bond acceptors: 2
    #H bond donors: 1
    #Freely Rotating Bonds: 1
    #Rule of 5 Violations: 0
    ACD/LogP: 2.16
    ACD/LogD (pH 5.5): 1.35
    ACD/BCF (pH 5.5): 3.74
    ACD/KOC (pH 5.5): 48.77
    ACD/LogD (pH 7.4): -0.46
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 88 Å2
    Polarizability: 24.6±0.5 10-24cm3
    Surface Tension: 53.7±5.0 dyne/cm
    Molar Volume: 180.7±5.0 cm3

    Click to predict properties on the Chemicalize site


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