Compound Q&A

How is 3-Fluoro-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzonitrile (CAS: 624741-47-5) typically synthesized?

Answer

3-Fluoro-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzonitrile
3-Fluoro-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzonitrile is typically synthesized via Suzuki-Miyaura coupling reactions. The synthesis involves the reaction of 3-fluorophenylboronic acid with 2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzonitrile in the presence of a palladium catalyst and a base. Commonly used catalysts include Pd(PPh3)4 and PdCl2(dppf), yielding the target compound with moderate to high selectivity.

About

English Name 3-Fluoro-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzonitrile
Molecular Formula C13H15BFNO2
Molecular Weight 17.03 g/mol
SMILES B1(OC(C(O1)(C)C)(C)C)C2=C(C=CC=C2F)C#N
InChIKey HIMZNJDDVIROEC-UHFFFAOYSA-N
Last Updated: 2025-10-26 09:38

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