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CS-W001157 4
Total: USD 88.00

6-BROMO-2-FLUORONICOTINIC ACID

  • CAS No. 1214345-17-1

  • Cat. No. CS-W000468
  • Purity≥97%
  • MDL No.MFCD13185804

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

6-BROMO-2-FLUORONICOTINIC ACID|CS-W000468

Structure of 1214345-17-1

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General Information

  • CAS No. 1214345-17-1
  • Cat. No. CS-W000468
  • Purity ≥97%
  • MDL No. MFCD13185804
  • Storage -20°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₆H₃BrFNO₂
  • Molecular Weight 220.00
  • Synonym(s) None
  • SMILES OC(=O)c1ccc(Br)nc1F

Description

6-Bromo-2-fluoronicotinic acid is a halogenated pyridine carboxylic acid featuring strategically positioned bromo and fluoro substituents at the 6- and 2-positions, respectively. This electronic modulation enhances reactivity in cross-coupling transformations. The carboxylic acid group enables direct derivatization or incorporation into bioactive scaffolds. Bench-stable and moisture-tolerant, it facilitates efficient synthesis of functionalized heterocycles under standard conditions.

Application

6-Bromo-2-fluoronicotinic acid serves as a versatile building block for the synthesis of fluorinated heterocycles and bioactive molecules. Its dual halogenation pattern enables palladium-catalyzed cross-coupling reactions, while the carboxylic acid group facilitates direct amidation or esterification. The compound exhibits good bench stability and is readily purified by recrystallization, making it suitable for scalable medicinal chemistry campaigns and API intermediate development.

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

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