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CS-W001157 4
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(5-Fluoroquinolin-8-yl)boronic acid

  • CAS No. 1072951-45-1

  • Cat. No. CS-0155793
  • Molecule weight190.97
  • Purity≥95%
  • MDL No.MFCD11504850

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

(5-Fluoroquinolin-8-yl)boronic acid|CS-0155793

Structure of 1072951-45-1

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General Information

  • CAS No. 1072951-45-1
  • Cat. No. CS-0155793
  • Purity ≥95%
  • MDL No. MFCD11504850
  • Storage -20°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₇BFNO₂
  • Molecular Weight 190.97
  • Synonym(s) None
  • SMILES C1=CC2=C(C(=CC=C2F)B(O)O)N=C1

Description

This boronate moiety integrates a 5-fluoroquinolin-8-yl scaffold, offering enhanced stability and reactivity in cross-coupling transformations. The electron-deficient quinoline core enables efficient palladium-catalyzed coupling under standard conditions, while the fluorine substituent modulates electronic properties and improves solubility in organic media.

Application

(5-Fluoroquinolin-8-yl)boronic acid serves as a versatile building block in palladium-catalyzed cross-coupling reactions, enabling efficient C–C bond formation with aryl halides and triflates. The quinoline scaffold provides enhanced metabolic stability and favorable electronic properties for medicinal chemistry applications. Its bench-stable boronic acid functionality facilitates straightforward handling, purification, and integration into diverse synthetic sequences, including the construction of biologically active heterocyclic scaffolds and pharmaceutical intermediates.

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-P330-P362+P364-P405-P501

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Computational Chemistry Data

  • TPSA   53.35
  • LogP   0.0537
  • H_Acceptors   3
  • H_Donors   2
  • Rotatable_Bonds   1

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