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CAS 57021-54-2

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4,5,6,7-Tetrahydrobenzo[b]thiophene-2-carbonitrile

Description:
4,5,6,7-Tetrahydrobenzo[b]thiophene-2-carbonitrile is a heterocyclic organic compound characterized by its unique bicyclic structure, which includes a thiophene ring fused to a cyclohexane-like system. This compound features a carbonitrile functional group (-C≡N) at the 2-position of the thiophene ring, contributing to its reactivity and potential applications in organic synthesis and medicinal chemistry. The presence of the tetrahydro moiety indicates that the compound is saturated, which can influence its physical properties, such as solubility and boiling point. Typically, compounds like this may exhibit interesting biological activities, making them candidates for pharmaceutical development. The molecular structure allows for various substitution patterns, which can further modify its chemical behavior and interactions. Additionally, the compound's CAS number, 57021-54-2, serves as a unique identifier for regulatory and safety information, facilitating its use in research and industry. Overall, 4,5,6,7-Tetrahydrobenzo[b]thiophene-2-carbonitrile is a versatile compound with potential applications in various fields of chemistry.
Formula:C9H9NS
InChI:InChI=1S/C9H9NS/c10-6-8-5-7-3-1-2-4-9(7)11-8/h5H,1-4H2
InChI key:InChIKey=IOQNRXMIUGPZRP-UHFFFAOYSA-N
SMILES:C(#N)C1=CC2=C(S1)CCCC2
Synonyms:
  • Benzo[b]thiophene-2-carbonitrile, 4,5,6,7-tetrahydro-
  • 4,5,6,7-Tetrahydrobenzo[b]thiophene-2-carbonitrile
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