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CAS 3507-53-7

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5-Chloro-2-benzothiazolecarboxylic acid

Description:
5-Chloro-2-benzothiazolecarboxylic acid is an organic compound characterized by its benzothiazole structure, which consists of a benzene ring fused to a thiazole ring. This compound features a carboxylic acid functional group and a chlorine substituent at the 5-position of the benzothiazole moiety. It is typically a white to off-white solid and is soluble in polar organic solvents. The presence of the carboxylic acid group imparts acidic properties, allowing it to participate in various chemical reactions, such as esterification and amidation. This compound is of interest in the field of pharmaceuticals and agrochemicals, often serving as an intermediate in the synthesis of biologically active molecules. Additionally, its chlorine atom can enhance the compound's reactivity and influence its biological activity. Safety data indicates that, like many chlorinated compounds, it should be handled with care due to potential toxicity and environmental impact. Overall, 5-Chloro-2-benzothiazolecarboxylic acid is a versatile compound with significant applications in chemical synthesis and research.
Formula:C8H4ClNO2S
InChI:InChI=1S/C8H4ClNO2S/c9-4-1-2-6-5(3-4)10-7(13-6)8(11)12/h1-3H,(H,11,12)
InChI key:InChIKey=TZCPBIKLIIUHTD-UHFFFAOYSA-N
SMILES:C(O)(=O)C=1SC=2C(N1)=CC(Cl)=CC2
Synonyms:
  • 2-Benzothiazolecarboxylic acid, 5-chloro-
  • 5-Chloro-2-benzothiazolecarboxylic acid
  • 5-Chlorobenzo[d]thiazole-2-carboxylic acid
  • 5-Chloro-1,3-benzothiazole-2-carboxylic acid
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