Cas no 1309207-94-0 (3-Butoxyazetidine hydrochloride)

3-Butoxyazetidine hydrochloride is a versatile organic compound featuring an azetidine ring substituted with a butoxy group and a hydrochloride salt. This structure imparts unique reactivity and solubility properties, making it valuable in pharmaceutical and agrochemical synthesis. The hydrochloride form enhances stability and handling, while the azetidine scaffold offers potential for bioactivity modulation. Its balanced lipophilicity and polar characteristics facilitate applications in medicinal chemistry, particularly as a building block for drug discovery. The compound’s well-defined stereochemistry and purity ensure reproducibility in research and industrial processes. Suitable for use in nucleophilic substitutions and ring-opening reactions, it serves as a key intermediate in the development of novel bioactive molecules.
3-Butoxyazetidine hydrochloride structure
1309207-94-0 structure
Product Name:3-Butoxyazetidine hydrochloride
CAS No:1309207-94-0
MF:C7H16ClNO
MW:165.661041259766
MDL:MFCD09907645
CID:4582701
Update Time:2025-10-24

3-Butoxyazetidine hydrochloride Chemical and Physical Properties

Names and Identifiers

    • 3-Butoxy-azetidine hydrochloride
    • 3-Butoxyazetidine hydrochloride
    • SB32758
    • MDL: MFCD09907645
    • Inchi: 1S/C7H15NO.ClH/c1-2-3-4-9-7-5-8-6-7;/h7-8H,2-6H2,1H3;1H
    • InChI Key: AQKPHICTVBTJLY-UHFFFAOYSA-N
    • SMILES: Cl.O(CCCC)C1CNC1

Computed Properties

  • Exact Mass: 165.0920418 g/mol
  • Monoisotopic Mass: 165.0920418 g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 10
  • Rotatable Bond Count: 4
  • Complexity: 71.3
  • Covalently-Bonded Unit Count: 2
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Topological Polar Surface Area: 21.3
  • Molecular Weight: 165.66

3-Butoxyazetidine hydrochloride Pricemore >>

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Additional information on 3-Butoxyazetidine hydrochloride

Introduction to 3-Butoxyazetidine Hydrochloride (CAS No: 1309207-94-0)

3-Butoxyazetidine Hydrochloride (CAS No: 1309207-94-0) is a specialized organic compound that has garnered significant attention in the field of pharmaceutical chemistry and bioorganic synthesis. This compound, characterized by its hydrochloride salt form, belongs to the azetidine class of heterocyclic compounds, which are widely recognized for their diverse biological activities and synthetic utility. The structural motif of 3-butoxyazetidine incorporates a butyl ether group attached to a five-membered azetidine ring, providing a unique scaffold that can be exploited for various chemical modifications and biological applications.

The chemical structure of 3-butoxyazetidine hydrochloride can be represented as C?H??NO·HCl, where the hydrochloride salt enhances its solubility in aqueous systems, making it a valuable intermediate in drug formulation and biochemical assays. The presence of the butoxy group introduces steric and electronic effects that can influence the reactivity and binding affinity of the molecule, making it a versatile building block in medicinal chemistry.

In recent years, 3-butoxyazetidine hydrochloride has been explored as a key intermediate in the synthesis of bioactive molecules. Its azetidine core is particularly interesting because it mimics the conformational flexibility of natural amino acid residues, such as proline, while offering additional functional handles for derivatization. This property has made it a candidate for developing novel pharmacophores targeting various therapeutic areas.

One of the most compelling aspects of 3-butoxyazetidine hydrochloride is its potential application in the development of enzyme inhibitors. The azetidine ring can serve as a scaffold to interact with specific enzymatic active sites, particularly those involving proteases and kinases. For instance, studies have shown that derivatives of azetidine have been effective in inhibiting bacterial proteases, which are crucial targets in antibiotic development. The butoxy group further modulates the interaction by providing steric hindrance or by participating in hydrogen bonding networks, enhancing the binding affinity.

Moreover, 3-butoxyazetidine hydrochloride has been investigated in the context of drug delivery systems. Its ability to form stable complexes with other molecules makes it an excellent candidate for encapsulating therapeutic agents. This property is particularly relevant in targeted drug delivery, where 3-butoxyazetidine hydrochloride-based carriers can improve bioavailability and reduce off-target effects. Recent advancements in nanotechnology have enabled the design of nanoparticles functionalized with 3-butoxyazetidine hydrochloride moieties, which show promise in delivering payloads to specific cellular compartments.

The pharmaceutical industry has also explored 3-butoxyazetidine hydrochloride as a precursor for synthesizing novel therapeutics. Its structural features allow for easy functionalization at multiple positions, enabling the creation of diverse chemical libraries for high-throughput screening. For example, researchers have utilized 3-butoxyazetidine hydrochloride to develop small-molecule inhibitors targeting inflammatory pathways. These inhibitors have shown promise in preclinical studies for treating conditions such as rheumatoid arthritis and inflammatory bowel disease.

Another area where 3-butoxyazetidine hydrochloride has found utility is in materials science. The compound’s ability to form coordination complexes with metal ions has led to its use in catalysis and as a ligand in metal-organic frameworks (MOFs). These MOFs have applications ranging from gas storage and separation to catalytic transformations, underscoring the versatility of 3-butoxyazetidine hydrochloride beyond pharmaceuticals.

In conclusion, 3-Butoxyazetidine Hydrochloride (CAS No: 1309207-94-0) represents a fascinating compound with broad applications across multiple scientific disciplines. Its unique structural features make it an invaluable tool for synthetic chemists and biologists alike. As research continues to uncover new methodologies and applications, the potential uses of 3-butoxyazetidine hydrochloride are expected to expand further, solidifying its role as a cornerstone molecule in modern chemical biology.

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