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CS-W001157 4
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2-bromo-6-fluoronicotinic acid

  • CAS No. 1214332-31-6

  • Cat. No. CS-W000666
  • Purity≥97%
  • MDL No.None

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

2-bromo-6-fluoronicotinic acid|CS-W000666

Structure of 1214332-31-6

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General Information

  • CAS No. 1214332-31-6
  • Cat. No. CS-W000666
  • Purity ≥97%
  • MDL No. None
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₆H₃BrFNO₂
  • Molecular Weight 220.00
  • Synonym(s) 2-bromo-6-fluoropyridine-3-carboxylic acid
  • SMILES [c-]1[c-]c(F)nc(c1C(=O)O)Br

Description

2-Bromo-6-fluoronicotinic acid features a strategically positioned bromine and fluorine substituent on the nicotinic acid scaffold, enabling selective functionalization in pharmaceutical synthesis. The electron-withdrawing halogens enhance reactivity in cross-coupling processes while maintaining stability under standard conditions. This compound serves as a key building block for bioactive heterocycles and advanced intermediates in medicinal chemistry.

Application

2-Bromo-6-fluoronicotinic acid serves as a versatile building block in medicinal chemistry, enabling palladium-catalyzed cross-coupling reactions due to its orthogonal halogen reactivity. The bromine and fluorine substituents facilitate selective functionalization, while the carboxylic acid group supports direct derivatization or amide formation. Its bench-stable nature and compatibility with standard synthetic workflows make it ideal for constructing complex heterocyclic scaffolds and API 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-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501

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Computational Chemistry Data

  • TPSA   50.19
  • LogP   1.6814
  • H_Acceptors   2
  • H_Donors   1
  • Rotatable_Bonds   1

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