ChemSpider 2D Image | 6-TERT-BUTYL 2-ETHYL 4H,5H,6H,7H-THIENO[2,3-C]PYRIDINE-2,6-DICARBOXYLATE | C15H21NO4S

6-TERT-BUTYL 2-ETHYL 4H,5H,6H,7H-THIENO[2,3-C]PYRIDINE-2,6-DICARBOXYLATE

  • Molecular FormulaC15H21NO4S
  • Average mass311.397 Da
  • Monoisotopic mass311.119141 Da
  • ChemSpider ID28420352

More details:

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

1135124-02-5 [RN]
2-Ethyl 6-(2-methyl-2-propanyl) 4,7-dihydrothieno[2,3-c]pyridine-2,6(5H)-dicarboxylate [ACD/IUPAC Name]
2-Ethyl-6-(2-methyl-2-propanyl)-4,7-dihydrothieno[2,3-c]pyridin-2,6(5H)-dicarboxylat [German] [ACD/IUPAC Name]
4,7-Dihydrothiéno[2,3-c]pyridine-2,6(5H)-dicarboxylate de 2-éthyle et de 6-(2-méthyl-2-propanyle) [French] [ACD/IUPAC Name]
6-TERT-BUTYL 2-ETHYL 4H,5H,6H,7H-THIENO[2,3-C]PYRIDINE-2,6-DICARBOXYLATE
Thieno[2,3-c]pyridine-2,6(5H)-dicarboxylic acid, 4,7-dihydro-, 6-(1,1-dimethylethyl) 2-ethyl ester [ACD/Index Name]
[1135124-02-5] [RN]
6-(tert-butyl) 2-ethyl 4,7-dihydrothieno[2,3-c]pyridine-2,6(5H)-dicarboxylate
6-O-tert-butyl 2-O-ethyl 5,7-dihydro-4H-thieno[2,3-c]pyridine-2,6-dicarboxylate
6-t-Butyl 2-ethyl 4H,5h,6h,7H-thieno[2,3-c]pyridine-2,6-dicarboxylate
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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: 443.4±45.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.1 mmHg at 25°C
    Enthalpy of Vaporization: 70.1±3.0 kJ/mol
    Flash Point: 222.0±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: 3.06
    ACD/LogD (pH 5.5): 3.60
    ACD/BCF (pH 5.5): 322.48
    ACD/KOC (pH 5.5): 2173.68
    ACD/LogD (pH 7.4): 3.60
    ACD/BCF (pH 7.4): 322.48
    ACD/KOC (pH 7.4): 2173.68
    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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