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CS-W001157 4
Total: USD 88.00

(3-Methyl-4-(trifluoromethyl)phenyl)boronic acid

  • CAS No. 864759-67-1

  • Cat. No. CS-0068092
  • Purity≥98%
  • MDL No.MFCD08706260

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

(3-Methyl-4-(trifluoromethyl)phenyl)boronic acid|CS-0068092

Structure of 864759-67-1

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General Information

  • CAS No. 864759-67-1
  • Cat. No. CS-0068092
  • Purity ≥98%
  • MDL No. MFCD08706260
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₈H₈BF₃O₂
  • Molecular Weight 203.95
  • Synonym(s) 3-METHYL-4-TRIFLUOROMETHYL-PHENYLBORONIC ACID
  • SMILES FC(C1=CC=C(B(O)O)C=C1C)(F)F

Description

This boronate moiety features a trifluoromethyl group that enhances electron deficiency and stability, enabling efficient Suzuki-Miyaura coupling under standard conditions. The 3-methyl substitution provides steric control, improving selectivity in cross-coupling reactions.

Application

(3-Methyl-4-(trifluoromethyl)phenyl)boronic acid serves as a versatile building block in Suzuki-Miyaura cross-coupling reactions, enabling efficient C–C bond formation under mild conditions. Its stability, ease of handling, and compatibility with diverse functional groups make it well-suited for constructing complex aryl scaffolds in medicinal chemistry and materials science 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 : H302
Precautionary Statements : P264-P270-P330-P501

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Computational Chemistry Data

  • TPSA   40.46
  • LogP   0.69362
  • H_Acceptors   2
  • H_Donors   2
  • Rotatable_Bonds   1

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