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CS-W001157 4
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2-(4-Bromo-2-fluorophenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane

  • CAS No. 1326316-85-1

  • Cat. No. CS-0174721
  • Purity≥97%
  • MDL No.None

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

2-(4-Bromo-2-fluorophenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane|CS-0174721

Structure of 1326316-85-1

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General Information

  • CAS No. 1326316-85-1
  • Cat. No. CS-0174721
  • Purity ≥97%
  • MDL No. None
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₂H₁₅BBrFO₂
  • Molecular Weight 300.96
  • Synonym(s) 4-Bromo-2-fluorophenylboronic Acid Pinacol Ester
  • SMILES CC1(C(C)(OB(O1)C2=C(F)C=C(Br)C=C2)C)C

Description

This boronate ester features a bromo-fluoro-substituted aryl group enabling selective cross-coupling in Suzuki-Miyaura reactions. The tetramethyl-1,3,2-dioxaborolane moiety imparts exceptional stability and ease of handling under ambient conditions.

Application

2-(4-Bromo-2-fluorophenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane serves as a versatile Suzuki-Miyaura coupling partner, enabling efficient C–C bond formation under mild conditions. The boronate ester exhibits excellent bench stability, tolerates diverse functional groups, and facilitates reliable cross-coupling with aryl and heteroaryl halides. Its robustness and predictable reactivity make it ideal for constructing complex biaryls and pharmaceutical scaffolds in 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

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Computational Chemistry Data

  • TPSA   18.46
  • LogP   2.8874
  • H_Acceptors   2
  • H_Donors   0
  • Rotatable_Bonds   1

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