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CS-W001157 4
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4-Chloropyridine-2,6-dicarboxylic acid

  • CAS No. 4722-94-5

  • Cat. No. CS-0038684
  • Purity≥95%
  • MDL No.MFCD04117894

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

4-Chloropyridine-2,6-dicarboxylic acid|CS-0038684

Structure of 4722-94-5

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General Information

  • CAS No. 4722-94-5
  • Cat. No. CS-0038684
  • Purity ≥95%
  • MDL No. MFCD04117894
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₇H₄ClNO₄
  • Molecular Weight 201.56
  • Synonym(s) Acide 4-chloropyridine-2,6-dicarboxylique
  • SMILES O=C(O)C=1N=C(C=C(Cl)C1)C(=O)O

Description

4-Chloropyridine-2,6-dicarboxylic acid features a pyridine core functionalized with chlorine and two carboxylic acid groups at the 4-, 2-, and 6-positions. This arrangement imparts strong electron-withdrawing character and enhanced solubility in polar solvents. The molecule serves as a versatile scaffold for ligand development, particularly in coordination chemistry and metal-organic framework synthesis. Its stability under standard bench conditions facilitates straightforward handling and integration into multi-step syntheses.

Application

4-Chloropyridine-2,6-dicarboxylic acid serves as a versatile building block in the synthesis of heterocyclic scaffolds and functionalized pyridine derivatives. Its orthogonal carboxylic acid and chlorine functionalities enable selective derivatization via amide formation, esterification, or cross-coupling reactions. The molecule exhibits good bench stability and facilitates purification through crystallization, making it suitable for applications in medicinal chemistry and materials science workflows.

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   87.49
  • LogP   1.1314
  • H_Acceptors   3
  • H_Donors   2
  • Rotatable_Bonds   2

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