ChemSpider 2D Image | 6-(tert-Butoxycarbonyl)-4,5,6,7-tetrahydrothieno[2,3-c]pyridine-2-carboxylic acid | C13H17NO4S

6-(tert-Butoxycarbonyl)-4,5,6,7-tetrahydrothieno[2,3-c]pyridine-2-carboxylic acid

  • Molecular FormulaC13H17NO4S
  • Average mass283.343 Da
  • Monoisotopic mass283.087830 Da
  • ChemSpider ID21109294

More details:

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

165947-51-3 [RN]
6-(tert-Butoxycarbonyl)-4,5,6,7-tetrahydrothieno[2,3-c]pyridine-2-carboxylic acid
6-{[(2-Methyl-2-propanyl)oxy]carbonyl}-4,5,6,7-tetrahydrothieno[2,3-c]pyridin-2-carbonsäure [German] [ACD/IUPAC Name]
6-{[(2-Methyl-2-propanyl)oxy]carbonyl}-4,5,6,7-tetrahydrothieno[2,3-c]pyridine-2-carboxylic acid [ACD/IUPAC Name]
Acide 6-{[(2-méthyl-2-propanyl)oxy]carbonyl}-4,5,6,7-tétrahydrothiéno[2,3-c]pyridine-2-carboxylique [French] [ACD/IUPAC Name]
Thieno[2,3-c]pyridine-2,6(5H)-dicarboxylic acid, 4,7-dihydro-, 6-(1,1-dimethylethyl) ester [ACD/Index Name]
[165947-51-3] [RN]
2-(4-pyridyl)Benzaldehyde
2-(pyridin-4-yl)benzaldehyde
474710-80-0 [RN]
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

CCRIS 4693 [DBID]

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

    Density: 1.3±0.1 g/cm3
    Boiling Point: 453.2±45.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.2 mmHg at 25°C
    Enthalpy of Vaporization: 75.1±3.0 kJ/mol
    Flash Point: 227.9±28.7 °C
    Index of Refraction: 1.581
    Molar Refractivity: 72.1±0.3 cm3
    #H bond acceptors: 5
    #H bond donors: 1
    #Freely Rotating Bonds: 3
    #Rule of 5 Violations: 0
    ACD/LogP: 2.30
    ACD/LogD (pH 5.5): 1.46
    ACD/BCF (pH 5.5): 2.90
    ACD/KOC (pH 5.5): 23.99
    ACD/LogD (pH 7.4): 0.17
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.22
    Polar Surface Area: 95 Å2
    Polarizability: 28.6±0.5 10-24cm3
    Surface Tension: 53.8±3.0 dyne/cm
    Molar Volume: 216.5±3.0 cm3

    Click to predict properties on the Chemicalize site


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