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CS-W001157 4
Total: USD 88.00

(3-(Difluoromethyl)phenyl)boronic acid

  • CAS No. 854690-87-2

  • Cat. No. CS-W006351
  • Purity≥97%
  • MDL No.MFCD09864670

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

(3-(Difluoromethyl)phenyl)boronic acid|CS-W006351

Structure of 854690-87-2

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General Information

  • CAS No. 854690-87-2
  • Cat. No. CS-W006351
  • Purity ≥97%
  • MDL No. MFCD09864670
  • Storage 4°C, stored under nitrogen
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₇H₇BF₂O₂
  • Molecular Weight 171.94
  • Synonym(s) [3-(difluoromethyl)phenyl]boronic acid
  • SMILES FC(C1=CC(B(O)O)=CC=C1)F

Description

This boronate moiety integrates a difluoromethyl group at the meta position of a phenyl ring, delivering enhanced stability and moisture tolerance. The electron-deficient arylboronic acid enables efficient Suzuki-Miyaura cross-coupling under standard conditions, offering reliable access to functionalized biaryls in medicinal chemistry and materials synthesis.

Application

(3-(Difluoromethyl)phenyl)boronic acid serves as a versatile building block in Suzuki-Miyaura cross-coupling reactions, enabling efficient construction of biaryl scaffolds with enhanced metabolic stability. The difluoromethyl group imparts favorable electronic and lipophilic properties, while the boronic acid functionality offers excellent bench stability and compatibility with diverse reaction conditions. Its predictable reactivity facilitates straightforward purification and integration into complex molecule synthesis.

Safety Information

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GHS Pictogram :
GHS No : GHS05,GHS07
Signal Word : Danger
UN#: 1759
Class : 8
Packing Group : Ⅲ
Hazard Statements : H315-H318-H335
Precautionary Statements : P261-P264-P271-P280-P302+P352-P304+P340-P362+P364-P405-P501

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Computational Chemistry Data

  • TPSA   40.46
  • LogP   0.304
  • H_Acceptors   2
  • H_Donors   2
  • Rotatable_Bonds   2

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