ChemSpider 2D Image | 5-tert-butyl 3-ethyl 4H,5H,6H,7H-thieno[3,2-c]pyridine-3,5-dicarboxylate | C15H21NO4S

5-tert-butyl 3-ethyl 4H,5H,6H,7H-thieno[3,2-c]pyridine-3,5-dicarboxylate

  • Molecular FormulaC15H21NO4S
  • Average mass311.397 Da
  • Monoisotopic mass311.119141 Da
  • ChemSpider ID34066156

More details:

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

1363381-39-8 [RN]
3-Ethyl 5-(2-methyl-2-propanyl) 6,7-dihydrothieno[3,2-c]pyridine-3,5(4H)-dicarboxylate [ACD/IUPAC Name]
3-Ethyl-5-(2-methyl-2-propanyl)-6,7-dihydrothieno[3,2-c]pyridin-3,5(4H)-dicarboxylat [German] [ACD/IUPAC Name]
5-tert-butyl 3-ethyl 4H,5H,6H,7H-thieno[3,2-c]pyridine-3,5-dicarboxylate
6,7-Dihydrothiéno[3,2-c]pyridine-3,5(4H)-dicarboxylate de 3-éthyle et de 5-(2-méthyl-2-propanyle) [French] [ACD/IUPAC Name]
Thieno[3,2-c]pyridine-3,5(4H)-dicarboxylic acid, 6,7-dihydro-, 5-(1,1-dimethylethyl) 3-ethyl ester [ACD/Index Name]
Chemistry 20028
Ethyl 5-Boc-6,7-dihydro-4H-thieno[3,2-c]pyridine-3-carboxylate
Ethyl 5-Boc-6,7-dihydro-4H-thieno-[3,2-c]pyridine-3-carboxylate
MFCD23105853

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

    Density: 1.2±0.1 g/cm3
    Boiling Point: 439.1±45.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.1 mmHg at 25°C
    Enthalpy of Vaporization: 69.6±3.0 kJ/mol
    Flash Point: 219.4±28.7 °C
    Index of Refraction: 1.544
    Molar Refractivity: 81.6±0.3 cm3
    #H bond acceptors: 5
    #H bond donors: 0
    #Freely Rotating Bonds: 5
    #Rule of 5 Violations: 0
    ACD/LogP: 3.10
    ACD/LogD (pH 5.5): 3.62
    ACD/BCF (pH 5.5): 330.07
    ACD/KOC (pH 5.5): 2210.13
    ACD/LogD (pH 7.4): 3.62
    ACD/BCF (pH 7.4): 330.07
    ACD/KOC (pH 7.4): 2210.13
    Polar Surface Area: 84 Å2
    Polarizability: 32.3±0.5 10-24cm3
    Surface Tension: 45.2±3.0 dyne/cm
    Molar Volume: 258.4±3.0 cm3

    Click to predict properties on the Chemicalize site


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