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CS-W001157 4
Total: USD 88.00

(3-Fluoro-4-(trifluoromethoxy)phenyl)boronic acid

  • CAS No. 187804-79-1

  • Cat. No. CS-0029681
  • Purity≥97%
  • MDL No.MFCD07368680

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

(3-Fluoro-4-(trifluoromethoxy)phenyl)boronic acid|CS-0029681

Structure of 187804-79-1

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General Information

  • CAS No. 187804-79-1
  • Cat. No. CS-0029681
  • Purity ≥97%
  • MDL No. MFCD07368680
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₇H₅BF₄O₃
  • Molecular Weight 223.92
  • Synonym(s) B-[3-Fluoro-4-(trifluoromethoxy)phenyl]boronic acid; [3-Fluoro-4-(trifluoromethoxy)phenyl]boronic acid; 3-Fluoro-4-(trifluoromethoxy)phenylboronic acid
  • SMILES FC(F)(F)OC1=CC=C(B(O)O)C=C1F

Description

This boronic acid features a trifluoromethoxy group that enhances stability and modulates electronic properties, while the fluorinated aryl ring improves metabolic resistance. It integrates readily into Suzuki-Miyaura cross-coupling reactions under standard conditions, delivering high yields with minimal byproduct formation.

Application

(3-Fluoro-4-(trifluoromethoxy)phenyl)boronic acid serves as a versatile building block in Suzuki-Miyaura cross-coupling reactions, enabling efficient construction of biaryl scaffolds. Its stability under ambient conditions and compatibility with diverse functional groups facilitate reliable synthesis of fluorinated aromatic compounds. The trifluoromethoxy moiety enhances metabolic stability and lipophilicity, making it valuable for medicinal chemistry applications.

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 : H315-H319-H335
Precautionary Statements : P261-P264-P271-P280-P302+P352-P304+P340-P362-P405-P501

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Computational Chemistry Data

  • TPSA   49.69
  • LogP   0.4041
  • H_Acceptors   3
  • H_Donors   2
  • Rotatable_Bonds   2

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