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CAS 72752-81-9

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Methyl 2-sulfanyl-1,3-benzoxazole-6-carboxylate

Description:
Methyl 2-sulfanyl-1,3-benzoxazole-6-carboxylate is a chemical compound characterized by its unique structure, which includes a benzoxazole ring fused with a thiol group and a carboxylate ester. This compound typically exhibits properties associated with both aromatic and heterocyclic compounds, including potential biological activity due to the presence of the sulfur atom and the benzoxazole moiety. It is often used in organic synthesis and may serve as an intermediate in the production of pharmaceuticals or agrochemicals. The presence of the methyl ester group suggests it may be soluble in organic solvents and could participate in various chemical reactions, such as hydrolysis or nucleophilic substitution. Additionally, the compound may exhibit specific spectral characteristics in techniques such as NMR and IR spectroscopy, which can be utilized for its identification and characterization. Safety data should be consulted for handling and storage, as with any chemical substance, to ensure proper laboratory practices.
Formula:C9H7NO3S
InChI:InChI=1/C9H7NO3S/c1-12-8(11)5-2-3-6-7(4-5)13-9(14)10-6/h2-4H,1H3,(H,10,14)
SMILES:COC(=O)c1ccc2c(c1)oc(n2)S
Synonyms:
  • 2-Mercaptobenzooxazole-6-carboxylic acid methyl ester
  • 6-Benzoxazolecarboxylic Acid, 2-Mercapto-, Methyl Ester
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