Compound Q&A

How is 3-(Trifluoromethyl)dibenzo[b,e]oxepin-11(6H)-one (CAS: 4504-94-3) typically synthesized?

Answer

3-(Trifluoromethyl)dibenzo[b,e]oxepin-11(6H)-one
3-(Trifluoromethyl)dibenzo[b,e]oxepin-11(6H)-one can be synthesized via a multistep reaction involving the condensation of 3-(trifluoromethyl)acrylic acid and vicinal ketals, followed by ring closure and subsequent dehydration. This process often requires the use of Lewis acids as catalysts and typically yields up to 80% purity.

About

CAS No 4504-94-3
English Name 3-(Trifluoromethyl)dibenzo[b,e]oxepin-11(6H)-one
Molecular Formula C15H9F3O2
Molecular Weight 278.23 g/mol
SMILES O=C1c2ccc(cc2OCc2c1cccc2)C(F)(F)F
InChIKey LJXVSEITOIGFPP-UHFFFAOYSA-N
Last Updated: 2025-10-28 23:23

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