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CS-W001157 4
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5-Bromo-1H-imidazole-2-carboxylic acid

  • CAS No. 1260753-02-3

  • Cat. No. CS-0018715
  • Purity≥97%
  • MDL No.MFCD09842486

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

5-Bromo-1H-imidazole-2-carboxylic acid|CS-0018715

Structure of 1260753-02-3

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General Information

  • CAS No. 1260753-02-3
  • Cat. No. CS-0018715
  • Purity ≥97%
  • MDL No. MFCD09842486
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₄H₃BrN₂O₂
  • Molecular Weight 190.98
  • Synonym(s) 4-Bromo-1H-imidazole-2-carboxylic acid
  • SMILES O=C(C1=NC=C(Br)N1)O

Description

5-Bromo-1H-imidazole-2-carboxylic acid features a brominated imidazole core with a carboxylic acid group at the 2-position, enabling direct conjugation or derivatization. The electron-withdrawing bromine enhances reactivity in cross-coupling processes, while the acidic proton facilitates salt formation and purification. This bench-stable, moisture-tolerant scaffold integrates efficiently into bioactive molecules and functional materials.

Application

5-Bromo-1H-imidazole-2-carboxylic acid serves as a versatile building block in medicinal chemistry, enabling direct incorporation of brominated imidazole motifs into bioactive scaffolds. Its carboxylic acid functionality facilitates amide bond formation and derivatization, while the bromine substituent supports palladium-catalyzed cross-coupling reactions. The compound exhibits good bench stability and is compatible with standard purification techniques, making it well-suited for iterative synthesis workflows in API 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-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501

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Computational Chemistry Data

  • TPSA   65.98
  • LogP   0.8704
  • H_Acceptors   2
  • H_Donors   2
  • Rotatable_Bonds   1

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