Cas no 1260773-84-9 (4-methyl-1H-imidazole-2-carboxylic acid hydrate)

4-Methyl-1H-imidazole-2-carboxylic acid hydrate is a heterocyclic organic compound featuring a carboxyl group at the 2-position and a methyl substituent at the 4-position of the imidazole ring. This hydrate form enhances stability and handling, making it suitable for synthetic applications in pharmaceuticals and agrochemicals. Its imidazole core serves as a versatile building block for coordination chemistry and catalysis, while the carboxylic acid functionality allows for further derivatization. The compound is particularly valuable in the synthesis of bioactive molecules and metal-organic frameworks (MOFs). High purity and consistent hydration ensure reliable performance in research and industrial processes.
4-methyl-1H-imidazole-2-carboxylic acid hydrate structure
1260773-84-9 structure
Product Name:4-methyl-1H-imidazole-2-carboxylic acid hydrate
CAS No:1260773-84-9
MF:C5H8N2O3
MW:144.128621101379
MDL:MFCD12974871
CID:4583325
Update Time:2025-11-02

4-methyl-1H-imidazole-2-carboxylic acid hydrate Chemical and Physical Properties

Names and Identifiers

    • 4-methyl-1H-imidazole-2-carboxylic acid hydrate
    • MDL: MFCD12974871
    • Inchi: 1S/C5H6N2O2.H2O/c1-3-2-6-4(7-3)5(8)9;/h2H,1H3,(H,6,7)(H,8,9);1H2
    • InChI Key: OYSGXVXHGQETFC-UHFFFAOYSA-N
    • SMILES: C(C1=NC=C(C)N1)(=O)O.O

Computed Properties

  • Hydrogen Bond Donor Count: 3
  • Hydrogen Bond Acceptor Count: 5
  • Heavy Atom Count: 10
  • Rotatable Bond Count: 1

4-methyl-1H-imidazole-2-carboxylic acid hydrate Security Information

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Additional information on 4-methyl-1H-imidazole-2-carboxylic acid hydrate

Comprehensive Overview of 4-methyl-1H-imidazole-2-carboxylic acid hydrate (CAS No. 1260773-84-9)

4-methyl-1H-imidazole-2-carboxylic acid hydrate (CAS No. 1260773-84-9) is a specialized organic compound that has garnered significant attention in pharmaceutical and biochemical research. This compound, characterized by its imidazole core and carboxylic acid functional group, serves as a versatile intermediate in the synthesis of various bioactive molecules. Its unique structural features make it valuable for applications in drug discovery, particularly in the development of enzyme inhibitors and receptor modulators.

The growing interest in imidazole derivatives stems from their widespread presence in natural products and pharmaceuticals. Researchers frequently search for "4-methyl-1H-imidazole-2-carboxylic acid hydrate uses" or "CAS 1260773-84-9 applications," reflecting the compound's relevance in modern chemistry. Recent studies highlight its potential in designing antimicrobial agents and anti-inflammatory drugs, aligning with the global focus on combating antibiotic resistance and chronic diseases.

From a synthetic perspective, 4-methyl-1H-imidazole-2-carboxylic acid hydrate offers excellent reactivity due to its hydrate form, which enhances solubility in aqueous systems. This property is critical for researchers investigating "water-soluble imidazole derivatives" or "green chemistry approaches." The compound's stability under physiological conditions also makes it a candidate for prodrug development, a trending topic in pharmaceutical innovation.

Analytical techniques such as NMR spectroscopy and HPLC are commonly employed to characterize CAS 1260773-84-9, addressing frequent queries like "how to analyze imidazole carboxylates." The compound's purity is crucial for reproducibility in research, prompting discussions about "high-purity heterocyclic building blocks" in scientific forums. Furthermore, its compatibility with peptide coupling reagents expands its utility in bioconjugation chemistry.

Environmental and safety considerations surrounding 4-methyl-1H-imidazole-2-carboxylic acid hydrate are frequently explored in searches like "biodegradable imidazole compounds." While not classified as hazardous, proper handling protocols are recommended, mirroring the industry's emphasis on laboratory safety standards. The compound's low toxicity profile compared to other heterocycles contributes to its popularity in medicinal chemistry workflows.

Market trends indicate rising demand for CAS 1260773-84-9, particularly from contract research organizations focusing on "fragment-based drug design." Its molecular weight (often searched as "4-methyl-1H-imidazole-2-carboxylic acid hydrate MW") and hydrogen bonding capacity make it ideal for molecular docking studies. The compound's role in developing kinase inhibitors remains a hot topic, given the ongoing research in cancer therapeutics.

Future research directions for 4-methyl-1H-imidazole-2-carboxylic acid hydrate may explore its potential in metal-organic frameworks (MOFs) or as a ligand in catalysis. These applications respond to emerging searches about "imidazoles in materials science" and "sustainable chemical processes." The compound's versatility ensures its continued importance across multiple scientific disciplines, from pharmacology to nanotechnology.

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