Cas no 102964-47-6 (Dicyclohexylamino-acetic acid)

Dicyclohexylamino-acetic acid is a versatile organic compound characterized by its cyclohexylamino and carboxyl functional groups. This structure imparts utility in applications such as organic synthesis, catalysis, and as a building block for more complex molecules. Its sterically hindered amine group enhances stability and selectivity in reactions, making it valuable for fine chemical and pharmaceutical intermediates. The carboxyl group provides reactivity for further derivatization, enabling diverse modifications. The compound's lipophilic cyclohexyl moieties contribute to solubility in nonpolar solvents, broadening its applicability in hydrophobic environments. Suitable for controlled reactions, it offers a balance of reactivity and stability, making it a practical choice for specialized synthetic pathways.
Dicyclohexylamino-acetic acid structure
Dicyclohexylamino-acetic acid structure
Product Name:Dicyclohexylamino-acetic acid
CAS No:102964-47-6
MF:C14H25NO2
MW:239.353804349899
CID:1073201
PubChem ID:3164602
Update Time:2025-05-20

Dicyclohexylamino-acetic acid Chemical and Physical Properties

Names and Identifiers

    • Dicyclohexylamino-acetic acid
    • 2-(dicyclohexylamino)acetic acid
    • (dicyclohexylamino)acetic acid
    • AC1MKX9N
    • ACMC-20ed21
    • CTK0G7302
    • Glycine, N,N-dicyclohexyl-
    • MolPort-003-991-721
    • SureCN5800001
    • N,N-DICYCLOHEXYL-GLYCINE
    • SCHEMBL5800001
    • DTXSID30390385
    • CS-0416137
    • 102964-47-6
    • AKOS009233734
    • F79619
    • 2-(dicyclohexylamino)aceticAcid
    • J-000851
    • MDL: MFCD06753438
    • Inchi: 1S/C14H25NO2/c16-14(17)11-15(12-7-3-1-4-8-12)13-9-5-2-6-10-13/h12-13H,1-11H2,(H,16,17)
    • InChI Key: JJBUINLKXFHHNU-UHFFFAOYSA-N
    • SMILES: OC(CN(C1CCCCC1)C1CCCCC1)=O

Computed Properties

  • Exact Mass: 267.21997
  • Monoisotopic Mass: 239.188529040g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 17
  • Rotatable Bond Count: 4
  • Complexity: 225
  • 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: 1.2
  • Topological Polar Surface Area: 40.5?2

Experimental Properties

  • PSA: 29.54

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Additional information on Dicyclohexylamino-acetic acid

Dicyclohexylamino-acetic Acid: A Comprehensive Overview

Dicyclohexylamino-acetic acid, identified by the CAS number 102964-47-6, is a compound of significant interest in various scientific and industrial applications. This compound, with its unique chemical structure, has garnered attention due to its potential in fields ranging from pharmaceuticals to materials science. In this article, we delve into the properties, applications, and recent advancements associated with dicyclohexylamino-acetic acid, providing a detailed and up-to-date analysis.

The chemical structure of dicyclohexylamino-acetic acid comprises a central acetic acid moiety with two cyclohexyl groups attached to the amino group. This configuration imparts the compound with distinctive physical and chemical properties. Recent studies have highlighted its stability under various conditions, making it suitable for use in diverse environments. Its molecular weight is approximately 313 g/mol, and it exists as a white crystalline powder at room temperature.

One of the most notable applications of dicyclohexylamino-acetic acid is in the field of drug discovery. Researchers have explored its potential as a building block for developing bioactive compounds with therapeutic effects. For instance, studies published in 2023 have demonstrated its role in synthesizing analogs that exhibit potent anti-inflammatory and antioxidant properties. These findings underscore its importance in pharmacological research and highlight its potential for future drug development.

In addition to its pharmaceutical applications, dicyclohexylamino-acetic acid has found utility in materials science. Its ability to form stable complexes with metal ions has led to its use in the synthesis of coordination polymers and metal-organic frameworks (MOFs). Recent advancements in this area have shown that these materials can be employed in gas storage, catalysis, and sensing technologies, further expanding the scope of this compound's applications.

The synthesis of dicyclohexylamino-acetic acid involves a multi-step process that typically begins with the reaction of cyclohexylamine with an appropriate acetylating agent. Recent optimizations in synthetic protocols have improved yields and reduced reaction times, making large-scale production more feasible. These improvements are critical for meeting the growing demand for this compound across various industries.

From an environmental perspective, understanding the toxicity and biodegradability of dicyclohexylamino-acetic acid is essential for ensuring its safe use. Studies conducted in 2023 have indicated that it exhibits low acute toxicity to aquatic organisms under standard testing conditions. Furthermore, research into its biodegradation pathways has revealed that it can be effectively metabolized by microbial communities under aerobic conditions.

In conclusion, dicyclohexylamino-acetic acid, CAS No. 102964-47-6, stands as a versatile compound with promising applications across multiple disciplines. Its role in drug discovery, materials science, and environmental studies positions it as a key player in contemporary scientific research. As ongoing studies continue to uncover new insights into its properties and potential uses, this compound is poised to make significant contributions to various fields in the years to come.

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