Cas no 1329698-91-0 (1-cyclohexyl-1H-Imidazole-4-carboxylic acid)

1-Cyclohexyl-1H-imidazole-4-carboxylic acid is a heterocyclic carboxylic acid derivative featuring a cyclohexyl substituent on the imidazole ring. This compound is of interest in medicinal chemistry and organic synthesis due to its versatile reactivity, particularly as a building block for the development of pharmacologically active molecules. The cyclohexyl group enhances lipophilicity, potentially improving membrane permeability in drug design applications. The carboxylic acid moiety allows for further functionalization, such as amide or ester formation, enabling structural diversification. Its stable imidazole core contributes to robust chemical stability under standard conditions. The compound is typically utilized in research settings for the synthesis of targeted bioactive compounds or as a scaffold in heterocyclic chemistry studies.
1-cyclohexyl-1H-Imidazole-4-carboxylic acid structure
1329698-91-0 structure
Product Name:1-cyclohexyl-1H-Imidazole-4-carboxylic acid
CAS No:1329698-91-0
MF:C10H14N2O2
MW:194.230362415314
CID:1104793
PubChem ID:67365305
Update Time:2025-06-07

1-cyclohexyl-1H-Imidazole-4-carboxylic acid Chemical and Physical Properties

Names and Identifiers

    • 1-cyclohexyl-1H-Imidazole-4-carboxylic acid
    • SCHEMBL2327699
    • CS-0444683
    • DB-407697
    • EN300-679265
    • 1-Cyclohexyl-1H-imidazole-4-carboxylicacid
    • 1329698-91-0
    • Inchi: 1S/C10H14N2O2/c13-10(14)9-6-12(7-11-9)8-4-2-1-3-5-8/h6-8H,1-5H2,(H,13,14)
    • InChI Key: PDYFUPBEQOVFHZ-UHFFFAOYSA-N
    • SMILES: OC(C1=CN(C=N1)C1CCCCC1)=O

Computed Properties

  • Exact Mass: 194.105527694g/mol
  • Monoisotopic Mass: 194.105527694g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 14
  • Rotatable Bond Count: 2
  • Complexity: 214
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 1.6
  • Topological Polar Surface Area: 55.1?2

1-cyclohexyl-1H-Imidazole-4-carboxylic acid Pricemore >>

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