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Chemical Structure| 58729-31-0 Chemical Structure| 58729-31-0

Structure of 58729-31-0

Chemical Structure| 58729-31-0

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Product Details of [ 58729-31-0 ]

CAS No. :58729-31-0
Formula : C7H13NO2S
M.W : 175.25
SMILES Code : O=C(C1NCCSC1)OCC
MDL No. :MFCD00107967

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Application In Synthesis of [ 58729-31-0 ]

* All experimental methods are cited from the reference, please refer to the original source for details. We do not guarantee the accuracy of the content in the reference.

  • Downstream synthetic route of [ 58729-31-0 ]

[ 58729-31-0 ] Synthesis Path-Downstream   1~1

  • 1
  • [ 59237-53-5 ]
  • [ 58729-31-0 ]
  • [ 1236119-51-9 ]
YieldReaction ConditionsOperation in experiment
95% at 20 - 90℃;Neat (no solvent); Inert atmosphere; Methyl 6-chloro-5-nitronicotinate (1.1 g, 5.10 mmol) was added to ethyl thiomorpholine-3-carboxylate (2.0 g, 11.41 mmol) neat while stirring at room temperature. The viscous yellow reaction was heated to 90° C. for one hour and then allowed to cool back to room temperature. The reaction was diluted with dichloromethane (20 mL) and purified via column chromatography (220 g SiO2, 20-30percent gradient, ethyl acetate in hexanes) to yield the title compound (1.71 g, 95percent) as a yellow oil. [M+H] calc'd for C15H18N2O6S, 356; found, 356.
 

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