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CS-W001157 4
Total: USD 88.00

2-(Trifluoromethyl)pyridine-4-boronic acid, pinacol ester

  • CAS No. 1036990-42-7

  • Cat. No. CS-W000625
  • Purity≥97%
  • MDL No.MFCD09607678

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

2-(Trifluoromethyl)pyridine-4-boronic acid, pinacol ester|CS-W000625

Structure of 1036990-42-7

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General Information

  • CAS No. 1036990-42-7
  • Cat. No. CS-W000625
  • Purity ≥97%
  • MDL No. MFCD09607678
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₂H₁₅BF₃NO₂
  • Molecular Weight 273.06
  • Synonym(s) 4-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)-2-(trifluoromethyl)pyridine
  • SMILES CC1(C)OB(OC1(C)C)c1ccnc(c1)C(F)(F)F

Description

2-(Trifluoromethyl)pyridine-4-boronic acid pinacol ester features a trifluoromethyl group at the ortho position, enhancing electronic withdrawal and metabolic stability. The pinacol boronate moiety enables reliable Suzuki-Miyaura coupling under standard conditions, offering robustness in cross-coupling reactions with aryl halides. This bench-stable reagent integrates efficiently into complex molecular architectures requiring electron-deficient pyridine motifs.

Application

2-(Trifluoromethyl)pyridine-4-boronic acid pinacol ester serves as a stable, bench-ready building block for Suzuki-Miyaura cross-coupling reactions. The trifluoromethyl group enhances metabolic stability and lipophilicity, while the pyridine core provides a versatile heterocyclic scaffold. Its boronic ester functionality enables reliable coupling with aryl and heteroaryl halides under mild conditions, offering high functional group tolerance and ease of purification—ideal 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

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Computational Chemistry Data

  • TPSA   31.35
  • LogP   2.3996
  • H_Acceptors   3
  • H_Donors   0
  • Rotatable_Bonds   1

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