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CAS 127557-05-5

:

7,9-Difluoro-3,4-dihydro-1-benzoxepin-5(2H)-one

Description:
7,9-Difluoro-3,4-dihydro-1-benzoxepin-5(2H)-one is a chemical compound characterized by its unique bicyclic structure, which includes a benzene ring fused to a heterocyclic oxepin moiety. The presence of two fluorine atoms at the 7 and 9 positions contributes to its distinct reactivity and potential biological activity. This compound typically exhibits properties associated with both aromatic and aliphatic systems, influencing its solubility and stability. It may participate in various chemical reactions, including nucleophilic substitutions and electrophilic additions, due to the electron-withdrawing nature of the fluorine substituents. The compound's structure suggests potential applications in medicinal chemistry, particularly in the development of pharmaceuticals, as the benzoxepin framework is often associated with bioactive compounds. Additionally, its specific stereochemistry and functional groups can affect its interaction with biological targets, making it a subject of interest in drug discovery and development. As with many fluorinated compounds, it may also exhibit unique physical properties, such as altered boiling and melting points compared to non-fluorinated analogs.
Formula:C10H8F2O2
InChI:InChI=1S/C10H8F2O2/c11-6-4-7-9(13)2-1-3-14-10(7)8(12)5-6/h4-5H,1-3H2
InChI key:InChIKey=AINGTXOPIXMSHI-UHFFFAOYSA-N
SMILES:O=C1C=2C(=C(F)C=C(F)C2)OCCC1
Synonyms:
  • 7,9-Difluoro-3,4-dihydro-1-benzoxepin-5(2H)-one
  • 1-Benzoxepin-5(2H)-one, 7,9-difluoro-3,4-dihydro-
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