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6-Fluoro-2-mercaptobenzothiazole(CAS: 8006-85-7)

6-Fluoro-2-mercaptobenzothiazole
CAS Number

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Basic Information

Molecular Formula
C7H4FNS2
Molecular Weight
185.24 g/mol

Chemical Identifiers

SMILES
S1C(NC2C=CC(=CC1=2)F)=S
InChIKey
XDZVUKOOUHIRKY-UHFFFAOYSA-N

FAQ

6-Fluoro-2-mercaptobenzothiazole is a crystalline solid with a molecular weight of approximately 218.04 g/mol. It is soluble in organic solvents such as ethanol and acetone but has low water solubility. Chemically, it is a thiazole derivative with a fluoro group and a mercapto group, which makes it reactive towards electrophiles. It is used in the synthesis of pharmaceuticals and as a stabilizer in various applications.
6-Fluoro-2-mercaptobenzothiazole can be synthesized via the Friedel-Crafts alkylation of benzothiazole with fluoroacetic acid, followed by reduction of the acetylation group. Commonly, this involves the use of metallic sodium in liquid ammonia as a reducing agent. The yield is typically high, around 90%, and the method ensures good selectivity and reactivity.
6-Fluoro-2-mercaptobenzothiazole is primarily used in the pharmaceutical industry for the synthesis of certain drugs, particularly anti-tumor agents and cardiovascular medications. It is also utilized in the polymer industry as a stabilizer and in the development of sensors and semiconductor materials.
When handling 6-Fluoro-2-mercaptobenzothiazole, it is important to wear appropriate personal protective equipment (PPE) such as gloves, goggles, and a laboratory coat. It should be handled in a well-ventilated area or under a fume hood to prevent inhalation of the vapor. Spills should be cleaned up using absorbent materials and disposed of according to local regulations. Always consult the Safety Data Sheet (SDS) for specific handling and disposal guidelines.

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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