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CS-W001157 4
Total: USD 88.00

(3-Fluoro-5-methylphenyl)boronic acid

  • CAS No. 850593-06-5

  • Cat. No. CS-W018065
  • Purity≥97%
  • MDL No.MFCD07363785

*For research and further manufacturing use only, not for direct human use.

(3-Fluoro-5-methylphenyl)boronic acid|CS-W018065

Structure of 850593-06-5

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General Information

  • CAS No. 850593-06-5
  • Cat. No. CS-W018065
  • Purity ≥97%
  • MDL No. MFCD07363785
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₇H₈BFO₂
  • Molecular Weight None
  • Synonym(s) 3-Fluoro-5-methylbenzeneboronic Acid (contains varying amounts of Anhydride)
  • SMILES CC1=CC(F)=CC(B(O)O)=C1

Description

This boronate moiety features a para-fluorinated, ortho-methylated aryl scaffold, enabling efficient cross-coupling under standard conditions. The electron-deficient ring enhances reactivity in Suzuki-Miyaura processes, while the sterically accessible boron center facilitates rapid transmetalation. Bench-stable and moisture-tolerant, it integrates seamlessly into complex molecule assembly workflows.

Application

(3-Fluoro-5-methylphenyl)boronic acid serves as a versatile building block in palladium-catalyzed cross-coupling reactions, enabling efficient C–C bond formation under mild conditions. Its ortho-fluoro and meta-methyl substituents provide enhanced stability and predictable reactivity in Suzuki-Miyaura couplings, facilitating the synthesis of substituted biaryls and functionalized heterocycles. The compound exhibits excellent bench stability, simplifies purification, and demonstrates broad functional group tolerance, making it well-suited for medicinal chemistry and process development workflows.

Safety Information

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GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H302-H315-H319-H335
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   40.46
  • LogP   -0.18608
  • H_Acceptors   2
  • H_Donors   2
  • Rotatable_Bonds   1

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