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CS-W001157 4
Total: USD 88.00

4,4'-(Pyridine-3,5-diyl)dibenzoicacid

  • CAS No. 171820-04-5

  • Cat. No. CS-0169883
  • Purity≥97%
  • MDL No.MFCD29919308

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

4,4'-(Pyridine-3,5-diyl)dibenzoicacid|CS-0169883

Structure of 171820-04-5

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General Information

  • CAS No. 171820-04-5
  • Cat. No. CS-0169883
  • Purity ≥97%
  • MDL No. MFCD29919308
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₉H₁₃NO₄
  • Molecular Weight 319.32
  • Synonym(s) 4,4'-(3,5-Pyridinediyl)bis-benzoic acid
  • SMILES O=C(O)C=1C=CC(=CC1)C=2C=NC=C(C2)C=3C=CC(=CC3)C(=O)O

Description

4,4'-(Pyridine-3,5-diyl)dibenzoic acid features a rigid, electron-deficient pyridine core flanked by carboxylic acid groups, enabling strong coordination in metal-organic frameworks. This bifunctional architecture supports stable complexation with transition metals and facilitates modular assembly in porous materials.

Application

4,4'-(Pyridine-3,5-diyl)dibenzoic acid serves as a versatile bifunctional building block in the synthesis of functionalized heterocycles and coordination polymers. Its orthogonal carboxylic acid and pyridine functionalities enable reliable coupling reactions and metal chelation, facilitating applications in medicinal chemistry scaffolds and materials science. The molecule exhibits excellent bench stability and clean purification profiles, making it well-suited for iterative synthetic 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-P280-P302+P352

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Computational Chemistry Data

  • TPSA   87.49
  • LogP   3.812
  • H_Acceptors   3
  • H_Donors   2
  • Rotatable_Bonds   4

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