2-Butylbenzo[d]isothiazol-3(2H)-one TCI B6021

Chemical Identity

CAS No.: 4299-07-4
PubChem: CID 9837171·SID 468590854
Formula: C11H13NOS
Molecular weight: 207.29 g/mol
Purity: >95.0%(GC)
Reference databases: ChemSpider·ECHA

Full identifiers (IUPAC, SMILES, InChIKey)

IUPAC: 2-butyl-1,2-benzothiazol-3-one
SMILES: CCCCN1C(=O)C2=CC=CC=C2S1
InChIKey: LUYIHWDYPAZCNN-UHFFFAOYSA-N
MDL: MDL09751282

Rp 3.735.900,00

~~Rp 2.628.150,00~~ Rp 3.735.900,00

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TCI B6021, 2-Butylbenzo[d]isothiazol-3(2H)-one (CAS No. 4299-07-4), is a heterocyclic building block belonging to the isothiazolone family, widely used in organic synthesis research. This compound serves as a versatile precursor for the derivatization of bioactive molecules, antimicrobial agents, and functional materials. Its N-butyl-substituted benzoisothiazolone core makes it a valuable intermediate in medicinal chemistry, agrochemical, and material science research workflows.