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CAS 1187928-21-7

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4-Bromo-2-benzothiazolecarboxylic acid

Description:
4-Bromo-2-benzothiazolecarboxylic acid is an organic compound characterized by its unique structure, which includes a bromine atom and a benzothiazole moiety. This compound typically appears as a solid and is soluble in organic solvents, with limited solubility in water. It features a carboxylic acid functional group, which imparts acidic properties and allows for potential reactivity in various chemical reactions, such as esterification or amidation. The presence of the bromine atom enhances its electrophilic character, making it useful in substitution reactions. Additionally, the benzothiazole ring contributes to its potential applications in pharmaceuticals, agrochemicals, and materials science due to its biological activity and ability to act as a building block in organic synthesis. Safety data sheets indicate that, like many brominated compounds, it should be handled with care, as it may pose environmental and health risks. Overall, 4-Bromo-2-benzothiazolecarboxylic acid is a versatile compound with significant implications in various fields of chemistry.
Formula:C8H4BrNO2S
InChI:InChI=1S/C8H4BrNO2S/c9-4-2-1-3-5-6(4)10-7(13-5)8(11)12/h1-3H,(H,11,12)
InChI key:InChIKey=SPKGFAPPOURYHT-UHFFFAOYSA-N
SMILES:BrC1=C2C(SC(C(O)=O)=N2)=CC=C1
Synonyms:
  • 4-Bromo-2-benzothiazolecarboxylic acid
  • 2-Benzothiazolecarboxylic acid, 4-bromo-
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