ChemSpider 2D Image | 2-tert-Butyl 8-methyl 5-thia-2-azaspiro[3.4]octane-2,8-dicarboxylate | C13H21NO4S

2-tert-Butyl 8-methyl 5-thia-2-azaspiro[3.4]octane-2,8-dicarboxylate

  • Molecular FormulaC13H21NO4S
  • Average mass287.375 Da
  • Monoisotopic mass287.119141 Da
  • ChemSpider ID30507800

More details:

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

1823264-51-2 [RN]
2-tert-Butyl 8-methyl 5-thia-2-azaspiro[3.4]octane-2,8-dicarboxylate
5-Thia-2-azaspiro[3.4]octane-2,8-dicarboxylate de 8-méthyle et de 2-(2-méthyl-2-propanyle) [French] [ACD/IUPAC Name]
5-Thia-2-azaspiro[3.4]octane-2,8-dicarboxylic acid, 2-(1,1-dimethylethyl) 8-methyl ester [ACD/Index Name]
8-Methyl 2-(2-methyl-2-propanyl) 5-thia-2-azaspiro[3.4]octane-2,8-dicarboxylate [ACD/IUPAC Name]
8-Methyl-2-(2-methyl-2-propanyl)-5-thia-2-azaspiro[3.4]octan-2,8-dicarboxylat [German] [ACD/IUPAC Name]
2-(tert-butyl) 8-methyl 5-thia-2-azaspiro[3.4]octane-2,8-dicarboxylate
2-t-Butyl 8-methyl 5-thia-2-azaspiro[3.4]octane-2,8-dicarboxylate
2-Tert-Butyl 8-Methyl 5-Thia-2-Azaspiro[3.4]Octane-2,8-Dicarboxylate(WX101877)
MFCD22479162
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.2±0.1 g/cm3
    Boiling Point: 384.1±42.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.9 mmHg at 25°C
    Enthalpy of Vaporization: 63.3±3.0 kJ/mol
    Flash Point: 186.1±27.9 °C
    Index of Refraction: 1.543
    Molar Refractivity: 73.8±0.4 cm3
    #H bond acceptors: 5
    #H bond donors: 0
    #Freely Rotating Bonds: 4
    #Rule of 5 Violations: 0
    ACD/LogP: 1.89
    ACD/LogD (pH 5.5): 2.10
    ACD/BCF (pH 5.5): 23.39
    ACD/KOC (pH 5.5): 332.36
    ACD/LogD (pH 7.4): 2.10
    ACD/BCF (pH 7.4): 23.39
    ACD/KOC (pH 7.4): 332.36
    Polar Surface Area: 81 Å2
    Polarizability: 29.2±0.5 10-24cm3
    Surface Tension: 46.7±5.0 dyne/cm
    Molar Volume: 234.1±5.0 cm3

    Click to predict properties on the Chemicalize site


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