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CAS 51793-98-7

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4-Methoxy-2(3H)-benzothiazolethione

Description:
4-Methoxy-2(3H)-benzothiazolethione, with the CAS number 51793-98-7, is an organic compound that belongs to the class of benzothiazole derivatives. This substance features a benzothiazole ring, which is a bicyclic structure containing both a benzene and a thiazole moiety, and is substituted with a methoxy group at the 4-position and a thione functional group. The presence of the thione group indicates that it contains a sulfur atom double-bonded to a carbon atom, which can influence its reactivity and potential applications. This compound is typically characterized by its solid state at room temperature and may exhibit moderate solubility in organic solvents. Its unique structure suggests potential biological activity, making it of interest in pharmaceutical research and development. Additionally, the methoxy group can enhance lipophilicity, potentially affecting the compound's interaction with biological systems. As with many chemical substances, safety data should be consulted to understand its handling and toxicity.
Formula:C8H7NOS2
InChI:InChI=1S/C8H7NOS2/c1-10-5-3-2-4-6-7(5)9-8(11)12-6/h2-4H,1H3,(H,9,11)
InChI key:InChIKey=JAZHYBLNLKNZHA-UHFFFAOYSA-N
SMILES:O(C)C1=C2C(SC(=S)N2)=CC=C1
Synonyms:
  • 4-Methoxy-2(3H)-benzothiazolethione
  • 2(3H)-Benzothiazolethione, 4-methoxy-
  • 2-Mercapto-4-methoxybenzothiazole
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