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CS-W001157 4
Total: USD 88.00

4-Bromo-2-fluorobenzeneboronic acid

  • CAS No. 216393-64-5

  • Cat. No. CS-0042069
  • Purity≥97%
  • MDL No.MFCD01318110

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

4-Bromo-2-fluorobenzeneboronic acid|CS-0042069

Structure of 216393-64-5

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General Information

  • CAS No. 216393-64-5
  • Cat. No. CS-0042069
  • Purity ≥97%
  • MDL No. MFCD01318110
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₆H₅BBrFO₂
  • Molecular Weight 218.82
  • Synonym(s) B-(4-bromo-2-fluorophenyl)boronic acid
  • SMILES OB(O)C1=C(F)C=C(Br)C=C1

Description

4-Bromo-2-fluorobenzeneboronic acid features a strategically positioned boronic acid group flanked by bromo and fluoro substituents, enabling selective cross-coupling in Suzuki-Miyaura reactions. The electron-deficient aromatic core enhances reactivity while maintaining bench-stable handling under standard conditions.

Application

4-Bromo-2-fluorobenzeneboronic acid serves as a versatile building block in Suzuki-Miyaura cross-coupling reactions, enabling the construction of biaryl scaffolds with high functional group tolerance. The bromo and fluoro substituents provide orthogonal reactivity for sequential transformations, while the boronic acid moiety ensures reliable coupling under mild conditions. Its bench-stable crystalline form facilitates handling and purification, making it well-suited for iterative synthesis in medicinal chemistry and materials development.

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-H319
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   0.268
  • H_Acceptors   2
  • H_Donors   2
  • Rotatable_Bonds   1

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