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CAS 64037-25-8

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5-chloro-2-(methylsulfanyl)-1,3-benzoxazole

Description:
5-Chloro-2-(methylsulfanyl)-1,3-benzoxazole is a heterocyclic organic compound characterized by the presence of a benzoxazole ring, which consists of a fused benzene and oxazole moiety. The compound features a chlorine atom at the 5-position and a methylthio group (-S-CH3) at the 2-position of the benzoxazole ring, contributing to its unique chemical properties. It is typically a solid at room temperature and may exhibit moderate solubility in organic solvents. The presence of the chlorine atom can influence its reactivity, making it a potential candidate for various chemical reactions, including nucleophilic substitutions. The methylthio group can also participate in reactions typical of sulfur-containing compounds. This compound may have applications in pharmaceuticals, agrochemicals, or materials science, depending on its biological activity and chemical behavior. As with many heterocycles, it may exhibit interesting electronic properties due to the delocalization of electrons within the aromatic system. Safety and handling precautions should be observed, as with all chemical substances, due to potential toxicity or reactivity.
Formula:C8H6ClNOS
InChI:InChI=1/C8H6ClNOS/c1-12-8-10-6-4-5(9)2-3-7(6)11-8/h2-4H,1H3
InChI key:DDQGNGANBLTNFD-UHFFFAOYSA-N
SMILES:CSc1nc2cc(ccc2o1)Cl
Synonyms:
  • Benzoxazole, 5-chloro-2- (methylthio)-
  • 5-Chloro-2-(methylsulfanyl)-1,3-benzoxazole
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