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2-(2-Fluoro-3-methylphenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane

  • CAS No. 1192548-08-5

  • Cat. No. CS-0041705
  • Purity≥98%
  • MDL No.MFCD18384075

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

2-(2-Fluoro-3-methylphenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane|CS-0041705

Structure of 1192548-08-5

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General Information

  • CAS No. 1192548-08-5
  • Cat. No. CS-0041705
  • Purity ≥98%
  • MDL No. MFCD18384075
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₃H₁₈BFO₂
  • Molecular Weight 236.09
  • Synonym(s) None
  • SMILES CC1(C)C(C)(C)OB(C2=CC=CC(C)=C2F)O1

Description

This boronate ester features a fluorinated methylphenyl group integrated with a stable tetramethyl-1,3,2-dioxaborolane core. The ortho-fluoro and meta-methyl substituents enhance regiochemical control in cross-coupling reactions. Bench-stable under standard conditions, it facilitates efficient Suzuki-Miyaura coupling with minimal protodeboronation.

Application

2-(2-Fluoro-3-methylphenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane serves as a stable, bench-ready boron building block for Suzuki-Miyaura cross-coupling reactions. Its ortho-fluoro and meta-methyl substituents enable selective functionalization in complex aromatic systems, with the tetramethyl-substituted dioxaborolane core offering enhanced stability and compatibility with diverse reaction conditions. Ideal for constructing biaryl motifs in pharmaceutical and agrochemical synthesis.

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   2.43332
  • H_Acceptors   2
  • H_Donors   0
  • Rotatable_Bonds   1

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