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

  • CAS No. 70631-93-5

  • Cat. No. CS-W019454
  • Purity≥97%
  • MDL No.None

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

5-Methyl-1H-imidazole-2-carboxylic acid|CS-W019454

Structure of 70631-93-5

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General Information

  • CAS No. 70631-93-5
  • Cat. No. CS-W019454
  • Purity ≥97%
  • MDL No. None
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₅H₆N₂O₂
  • Molecular Weight 126.11
  • Synonym(s) 4-Methyl-1H-imidazole-2-carboxylic acid
  • SMILES O=C(C1=NC=C(C)N1)O

Description

5-Methyl-1H-imidazole-2-carboxylic acid features a methyl-substituted imidazole core with a carboxylic acid group at the 2-position, delivering enhanced solubility and stability under standard conditions. This scaffold integrates readily into bioactive molecules, enabling efficient access to pharmaceutical intermediates through modular functionalization.

Application

5-Methyl-1H-imidazole-2-carboxylic acid serves as a versatile building block in medicinal chemistry, enabling the synthesis of imidazole-based scaffolds prevalent in bioactive molecules. Its carboxylic acid group facilitates direct coupling reactions, while the methyl-substituted imidazole core offers enhanced metabolic stability and favorable pharmacokinetic properties. The compound exhibits good bench stability and is compatible with standard peptide coupling and heterocycle functionalization protocols.

Synthesis

  • Route1
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    • In-stock
      5-Methyl-1H-imidazole-2-carboxylic acid|CS-W019454
      70631-93-5

    References

    • Chemische Berichte, , vol. 68, p. 2283,2289

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   65.98
  • LogP   0.41632
  • H_Acceptors   2
  • H_Donors   2
  • Rotatable_Bonds   1

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