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CAS 2602-85-9

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2-Benzothiazolecarbonitrile

Description:
2-Benzothiazolecarbonitrile, with the CAS number 2602-85-9, is an organic compound characterized by its unique structure that combines a benzothiazole moiety with a nitrile functional group. This compound typically appears as a solid and is known for its aromatic properties, which contribute to its stability and reactivity. It is often utilized in various chemical applications, including as an intermediate in the synthesis of pharmaceuticals, agrochemicals, and dyes. The presence of the nitrile group imparts significant polarity, enhancing its solubility in polar solvents. Additionally, 2-benzothiazolecarbonitrile exhibits biological activity, making it of interest in medicinal chemistry for potential therapeutic applications. Its chemical behavior is influenced by the electron-withdrawing nature of the nitrile group and the heterocyclic benzothiazole ring, which can participate in various chemical reactions, including nucleophilic substitutions and cycloadditions. Overall, 2-benzothiazolecarbonitrile is a versatile compound with important implications in both industrial and research settings.
Formula:C8H4N2S
InChI:InChI=1S/C8H4N2S/c9-5-8-10-6-3-1-2-4-7(6)11-8/h1-4H
InChI key:UYHQUNLVWOAJQW-UHFFFAOYSA-N
SMILES:C1=CC=C2C(=C1)N=C(S2)C#N
Synonyms:
  • 2-Cyanobenzothiazole
  • Benzo[d]thiazole-2-carbonitrile
  • 134912
  • 2-CYANO-BENZO[D]THIAZOLE
  • 2-benzothiazolecarbonitrile
  • 2-Benzothiazolecarbonitrile(7CI,8CI,9CI)
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