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CS-W001157 4
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4-(Pyridin-4-yl)-1H-pyrrole-3-carboxylic acid

  • CAS No. 197774-71-3

  • Cat. No. CS-0432883
  • Purity≥97%
  • MDL No.None

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

4-(Pyridin-4-yl)-1H-pyrrole-3-carboxylic acid|CS-0432883

Structure of 197774-71-3

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General Information

  • CAS No. 197774-71-3
  • Cat. No. CS-0432883
  • Purity ≥97%
  • MDL No. None
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₀H₈N₂O₂
  • Molecular Weight 188.18
  • Synonym(s) 4-PYRIDIN-4-YL-1H-PYRROLE-3-CARBOXYLIC ACID
  • SMILES O=C(C1=CNC=C1C2=CC=NC=C2)O

Description

4-(Pyridin-4-yl)-1H-pyrrole-3-carboxylic acid integrates a pyridyl moiety with a carboxylic acid-functionalized pyrrole scaffold, enabling direct conjugation in bioconjugation and medicinal chemistry applications. The electron-deficient pyridine enhances solubility and facilitates metal coordination, while the acidic proton supports salt formation for improved handling. This structure serves as a rigid, planar building block for heterocyclic libraries and functional materials.

Application

4-(Pyridin-4-yl)-1H-pyrrole-3-carboxylic acid serves as a versatile heterocyclic building block for medicinal chemistry and materials science. Its conjugated pyridyl-pyrrole core enables robust π-extended systems, while the carboxylic acid group facilitates direct coupling reactions, amide formation, or salt preparation. The molecule exhibits bench stability, good solubility in common organic solvents, and tolerance to standard reaction conditions, making it suitable for modular synthesis of bioactive scaffolds and functionalized polymers.

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-H312-H332
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P330-P363-P501

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Computational Chemistry Data

  • TPSA   65.98
  • LogP   1.7749
  • H_Acceptors   2
  • H_Donors   2
  • Rotatable_Bonds   2

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