Found 3977 results

Search term: MF = 'C_{11}H_{20}N_{2}O_{4}S'
ChemSpider 2D Image | tert-butyl 3,3-dioxo-3??-thia-7,9-diazabicyclo[3.3.1]nonane-7-carboxylate | C11H20N2O4S

tert-butyl 3,3-dioxo-3??-thia-7,9-diazabicyclo[3.3.1]nonane-7-carboxylate

  • Molecular FormulaC11H20N2O4S
  • Average mass276.353 Da
  • Monoisotopic mass276.114380 Da
  • ChemSpider ID34066361

More details:

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

1419101-41-9 [RN]
2-Methyl-2-propanyl 3-thia-7,9-diazabicyclo[3.3.1]nonane-7-carboxylate 3,3-dioxide [ACD/IUPAC Name]
2-Methyl-2-propanyl-3-thia-7,9-diazabicyclo[3.3.1]nonan-7-carboxylat-3,3-dioxid [German] [ACD/IUPAC Name]
3,3-Dioxyde de -3-thia-7,9-diazabicyclo[3.3.1]nonane-7-carboxylate de 2-méthyl-2-propanyle [French] [ACD/IUPAC Name]
3-Thia-7,9-diazabicyclo[3.3.1]nonane-7-carboxylic acid, 1,1-dimethylethyl ester, 3,3-dioxide [ACD/Index Name]
tert-butyl 3,3-dioxo-3??-thia-7,9-diazabicyclo[3.3.1]nonane-7-carboxylate
7-Boc-3-Thia-7,9-diazabicyclo[3.3.1]nonane-3,3-dioxide
7-Boc-3-Thia-7,9-diazabicyclo-[3.3.1]nonane-3,3-dioxide
MFCD23106401

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

    Density: 1.2±0.1 g/cm3
    Boiling Point: 454.4±45.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.1 mmHg at 25°C
    Enthalpy of Vaporization: 71.4±3.0 kJ/mol
    Flash Point: 228.6±28.7 °C
    Index of Refraction: 1.517
    Molar Refractivity: 67.1±0.4 cm3
    #H bond acceptors: 6
    #H bond donors: 1
    #Freely Rotating Bonds: 2
    #Rule of 5 Violations: 0
    ACD/LogP: -0.09
    ACD/LogD (pH 5.5): 0.36
    ACD/BCF (pH 5.5): 1.10
    ACD/KOC (pH 5.5): 36.90
    ACD/LogD (pH 7.4): 0.38
    ACD/BCF (pH 7.4): 1.14
    ACD/KOC (pH 7.4): 38.34
    Polar Surface Area: 84 Å2
    Polarizability: 26.6±0.5 10-24cm3
    Surface Tension: 41.9±3.0 dyne/cm
    Molar Volume: 221.5±3.0 cm3

    Click to predict properties on the Chemicalize site


    Advertisement