1,3-Benzothiazole-6-carboxylic acid(CAS: 3622-35-3)

CAS Number
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Basic Information
Molecular Formula
C8H5NO2S
Molecular Weight
179.2 g/mol
Physical Properties
Melting Point
245-251 °C (lit.)
Boiling Point
387.7℃ at 760 mmHg
Chemical Identifiers
SMILES
OC(=O)c1ccc2ncsc2c1
InChIKey
DMPZJACLHDWUFS-UHFFFAOYSA-N
Database References
MDL Number
MFCD00111651
FAQ
1,3-Benzothiazole-6-carboxylic acid (CAS: 3622-35-3) is a crystalline solid with a molecular weight of approximately 200.22 g/mol. It has a solubility of around 0.2 g/L in water. Chemically, it is moderately reactive towards nucleophiles and can undergo esterification or amidation reactions. It can form complexes with metals and undergo condensation reactions with ammonia.
1,3-Benzothiazole-6-carboxylic acid can be synthesized by the condensation of benzothiazole with a carboxylic acid chloride or anhydride. Common catalysts include imidazole or triethylamine. The reaction involves the formation of an ester or amide bond, typically with high selectivity and good yield.
1,3-Benzothiazole-6-carboxylic acid (CAS: 3622-35-3) is used in pharmaceuticals for the synthesis of certain drugs, in polymers as a stabilizer, and in sensors for detecting specific analytes. It also finds applications in the synthesis of semiconductors and as a reagent in organic chemistry.
What precautions should be taken when handling 1,3-Benzothiazole-6-carboxylic acid (CAS: 3622-35-3)?
When handling 1,3-Benzothiazole-6-carboxylic acid (CAS: 3622-35-3), proper personal protective equipment (PPE) such as gloves and safety glasses should be worn. The substance should be handled in a fume hood to avoid inhalation of dust or vapors. In case of a spill, it should be handled according to the safety data sheet (SDS). Storage should be in a cool, dry place away from direct sunlight and incompatible materials.
Safety Notice
Please verify product specifications and safety data before use. Contact the supplier for detailed safety information.
Always follow proper handling procedures
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