Cas no 2090478-31-0 (4,5-Dibromo-1-ethyl-1H-imidazole-2-carboxylic acid)

4,5-Dibromo-1-ethyl-1H-imidazole-2-carboxylic acid is a brominated imidazole derivative with a carboxylic acid functional group, offering versatility in synthetic chemistry applications. Its dibromo substitution pattern enhances reactivity, making it a valuable intermediate for constructing complex heterocyclic frameworks. The ethyl group at the N1 position improves solubility in organic solvents, facilitating handling in reaction conditions. This compound is particularly useful in pharmaceutical and agrochemical research, where it serves as a precursor for bioactive molecules. Its structural features enable selective modifications, allowing for tailored derivatization. The carboxylic acid moiety provides a handle for further functionalization via esterification, amidation, or other coupling reactions, enhancing its utility in diverse synthetic pathways.
4,5-Dibromo-1-ethyl-1H-imidazole-2-carboxylic acid structure
2090478-31-0 structure
Product Name:4,5-Dibromo-1-ethyl-1H-imidazole-2-carboxylic acid
CAS No:2090478-31-0
MF:C6H6Br2N2O2
MW:297.932039737701
CID:5267359
Update Time:2025-05-22

4,5-Dibromo-1-ethyl-1H-imidazole-2-carboxylic acid Chemical and Physical Properties

Names and Identifiers

    • 4,5-Dibromo-1-ethyl-1H-imidazole-2-carboxylic acid
    • 4,5-Dibromo-1-ethyl-1H-imidazole-2-carboxylicacid
    • 1H-Imidazole-2-carboxylic acid, 4,5-dibromo-1-ethyl-
    • Inchi: 1S/C6H6Br2N2O2/c1-2-10-4(8)3(7)9-5(10)6(11)12/h2H2,1H3,(H,11,12)
    • InChI Key: IDSVANYDMFMLIU-UHFFFAOYSA-N
    • SMILES: BrC1=C(N=C(C(=O)O)N1CC)Br

Computed Properties

  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 12
  • Rotatable Bond Count: 2
  • Complexity: 190
  • XLogP3: 2.2
  • Topological Polar Surface Area: 55.1

4,5-Dibromo-1-ethyl-1H-imidazole-2-carboxylic acid Pricemore >>

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