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CAS 139487-07-3

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6-(Bromomethyl)-3-methyl-2(3H)-benzothiazolone

Description:
6-(Bromomethyl)-3-methyl-2(3H)-benzothiazolone, with the CAS number 139487-07-3, is a chemical compound that features a benzothiazolone core, which is a bicyclic structure containing both a benzene ring and a thiazole ring. This compound is characterized by the presence of a bromomethyl group at the 6-position and a methyl group at the 3-position of the benzothiazolone structure. The bromomethyl group enhances its reactivity, making it useful in various chemical synthesis applications, including as an intermediate in organic synthesis. The compound may exhibit biological activity, which can be of interest in pharmaceutical research. Its solubility and stability can vary depending on the solvent and conditions, and it is important to handle it with care due to the presence of bromine, which can be hazardous. Overall, this compound is significant in the fields of organic chemistry and medicinal chemistry, where it may serve as a building block for more complex molecules.
Formula:C9H8BrNOS
InChI:InChI=1S/C9H8BrNOS/c1-11-7-3-2-6(5-10)4-8(7)13-9(11)12/h2-4H,5H2,1H3
InChI key:InChIKey=GSAPDPCHDJTVQB-UHFFFAOYSA-N
SMILES:CN1C=2C(=CC(CBr)=CC2)SC1=O
Synonyms:
  • 2(3H)-Benzothiazolone, 6-(bromomethyl)-3-methyl-
  • 6-(Bromomethyl)-3-methyl-2(3H)-benzothiazolone
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