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CAS 38555-41-8

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Methyl 3-oxotetrahydrothiopyran-2-carboxylate

Description:
Methyl 3-oxotetrahydrothiopyran-2-carboxylate is a chemical compound characterized by its unique structure, which includes a tetrahydrothiopyran ring, a ketone functional group, and an ester moiety. This compound typically exhibits a molecular formula that reflects its complex structure, incorporating carbon, hydrogen, oxygen, and sulfur atoms. It is generally a colorless to pale yellow liquid or solid, depending on its purity and specific conditions. The presence of the thiopyran ring contributes to its potential reactivity, particularly in nucleophilic substitution reactions. Methyl 3-oxotetrahydrothiopyran-2-carboxylate may be utilized in organic synthesis, particularly in the development of pharmaceuticals and agrochemicals, due to its ability to serve as an intermediate in various chemical reactions. Additionally, its properties may include moderate solubility in organic solvents and limited solubility in water, which is common for many organic compounds with ester functionalities. Safety data should be consulted for handling and storage, as with any chemical substance.
Formula:C7H10O3S
InChI:InChI=1S/C7H10O3S/c1-10-7(9)6-5(8)3-2-4-11-6/h6H,2-4H2,1H3
InChI key:InChIKey=CEDARSWTTYNIHA-UHFFFAOYSA-N
SMILES:C(OC)(=O)C1C(=O)CCCS1
Synonyms:
  • Methyl 3-oxo-2,3,4,5-tetrahydro-6H-thiopyran-2-carboxylate
  • Methyl 3-oxotetrahydrothiopyran-2-carboxylate
  • 2H-Thiopyran-2-carboxylic acid, tetrahydro-3-oxo-, methyl ester
  • Methyl 3-oxotetrahydro-2H-thiopyran-2-carboxylate
  • Methyl tetrahydro-3-oxo-6H-thiopyran-2-carboxylate
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