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CAS 81321-10-0

:

methyl 3-isothiocyanatothiophene-2-carboxylate

Description:
Methyl 3-isothiocyanatothiophene-2-carboxylate, with the CAS number 81321-10-0, is a chemical compound characterized by its unique structure that includes both isothiocyanate and thiophene functionalities. This compound typically appears as a yellow to brownish liquid or solid, depending on its purity and form. It is known for its reactivity, particularly due to the presence of the isothiocyanate group, which can participate in various nucleophilic reactions. The thiophene ring contributes to its aromatic properties, enhancing its stability and potential applications in organic synthesis. Methyl 3-isothiocyanatothiophene-2-carboxylate is often utilized in the synthesis of biologically active compounds and may exhibit interesting biological activities, including antimicrobial or anticancer properties. Additionally, it is important to handle this compound with care, as isothiocyanates can be irritants and may pose health risks upon exposure. Proper safety protocols should be followed when working with this substance in a laboratory setting.
Formula:C7H5NO2S2
InChI:InChI=1/C7H5NO2S2/c1-10-7(9)6-5(8-4-11)2-3-12-6/h2-3H,1H3
SMILES:COC(=O)c1c(ccs1)N=C=S
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