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CS-W001157 4
Total: USD 88.00

5-Bromo-4-methyl-2-pyridinecarboxylic acid

  • CAS No. 886365-02-2

  • Cat. No. CS-D1645
  • Purity≥98%
  • MDL No.MFCD07375100

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

5-Bromo-4-methyl-2-pyridinecarboxylic acid|CS-D1645

Structure of 886365-02-2

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General Information

  • CAS No. 886365-02-2
  • Cat. No. CS-D1645
  • Purity ≥98%
  • MDL No. MFCD07375100
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₇H₆BrNO₂
  • Molecular Weight 216.03
  • Synonym(s) 5-Bromo-4-methylpyridine-2-carboxylic acid; 5-Bromo-4-methylpyridine-2-carboxylicacid
  • SMILES O=C(C1=NC=C(Br)C(C)=C1)O

Description

5-Bromo-4-methyl-2-pyridinecarboxylic acid features a sterically accessible pyridine core with complementary electron-withdrawing bromo and electron-donating methyl groups, enabling efficient coupling in cross-coupling and amide formation reactions under standard conditions.

Application

5-Bromo-4-methyl-2-pyridinecarboxylic acid serves as a versatile building block in medicinal chemistry and synthetic organic chemistry. Its structure features a pyridine core with orthogonal functional groups—bromine for cross-coupling reactions and a carboxylic acid for derivatization—enabling efficient access to substituted heterocycles. The methyl group provides steric and electronic modulation, while the compound exhibits good bench stability and facilitates straightforward purification, making it well-suited for iterative synthesis workflows and API intermediate development.

Synthesis

  • Route1
    • null|null
      1122090-37-2
    • ~93%
    • In-stock
      5-Bromo-4-methyl-2-pyridinecarboxylic acid|CS-D1645
      886365-02-2

    References

    • Hoffmann-La Roche Inc.; Alam, Muzaffar; Du Bois, Daisy Joe; Hawley, Ronald Charles; Bhagirath, Niala; Kennedy-Smith, Joshua; Wilhelm, Robert Stephen Patent: US2013/158049 A1, 2013 ; Location in patent: Paragraph 0168 ;
  • Route2

    References

    • WO2012/143329 A1, ; Page/Page column 142-143 ; WO 2012/143329 A1
  • Route3

    References

    • US2011/71150 A1, ;

Safety Information

Download SDS
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   1.85072
  • H_Acceptors   2
  • H_Donors   1
  • Rotatable_Bonds   1

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