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CS-W001157 4
Total: USD 88.00

(2-(Trifluoromethyl)pyridin-3-yl)boronic acid

  • CAS No. 947533-39-3

  • Cat. No. CS-0106243
  • Molecule weight190.92
  • Purity≥98%
  • MDL No.MFCD09271791

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

(2-(Trifluoromethyl)pyridin-3-yl)boronic acid|CS-0106243

Structure of 947533-39-3

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General Information

  • CAS No. 947533-39-3
  • Cat. No. CS-0106243
  • Purity ≥98%
  • MDL No. MFCD09271791
  • Storage -20°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₆H₅BF₃NO₂
  • Molecular Weight 190.92
  • Synonym(s) 2-(Trifluoromethyl)pyridine-3-boronic acid
  • SMILES OB(C1=C(C(F)(F)F)N=CC=C1)O

Description

This boronate moiety integrates a trifluoromethylpyridine scaffold, delivering enhanced stability and solubility in polar solvents. The electron-deficient pyridine ring enables efficient Suzuki-Miyaura coupling under mild conditions, while the trifluoromethyl group imparts metabolic resistance and improved lipophilicity for medicinal chemistry applications.

Application

(2-(Trifluoromethyl)pyridin-3-yl)boronic acid serves as a versatile building block in Suzuki-Miyaura cross-coupling reactions, enabling efficient construction of biaryl architectures. Its trifluoromethylpyridine motif imparts enhanced metabolic stability and modulated electronic properties, making it valuable for medicinal chemistry applications. The boronic acid functionality offers good bench stability, compatibility with diverse reaction conditions, and straightforward purification via recrystallization or chromatography.

Safety Information

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GHS Pictogram :
GHS No : GHS06
Signal Word : Danger
UN#: 2811
Class : 6.1
Packing Group : Ⅲ
Hazard Statements : H301
Precautionary Statements : P264-P270-P330-P405-P501

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Computational Chemistry Data

  • TPSA   53.35
  • LogP   -0.2198
  • H_Acceptors   3
  • H_Donors   2
  • Rotatable_Bonds   1

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