Cas no 679837-26-4 (2-(4-tert-Butylphenoxy)butanoyl Chloride)

2-(4-tert-Butylphenoxy)butanoyl Chloride is a specialized organic compound primarily used as an intermediate in the synthesis of fine chemicals, pharmaceuticals, and agrochemicals. Its key structural features include a tert-butylphenoxy group and a reactive acyl chloride moiety, enabling efficient acylation reactions. The tert-butyl substituent enhances steric and electronic properties, improving selectivity in coupling reactions. This compound is valued for its high purity and stability under controlled conditions, ensuring consistent performance in synthetic applications. Suitable for use under inert atmospheres, it is commonly employed in laboratory and industrial settings where precise functionalization of target molecules is required. Proper handling is essential due to its moisture sensitivity and reactivity.
2-(4-tert-Butylphenoxy)butanoyl Chloride structure
679837-26-4 structure
Product Name:2-(4-tert-Butylphenoxy)butanoyl Chloride
CAS No:679837-26-4
MF:C14H19ClO2
MW:254.752463579178
MDL:MFCD12197839
CID:393850
PubChem ID:46779592
Update Time:2025-06-13

2-(4-tert-Butylphenoxy)butanoyl Chloride Chemical and Physical Properties

Names and Identifiers

    • Butanoyl chloride, 2-[4-(1,1-dimethylethyl)phenoxy]-
    • 2-(4-tert-butylphenoxy)butanoyl chloride
    • AKOS005173320
    • DTXSID60675490
    • MFCD12197839
    • VS-04696
    • 679837-26-4
    • 2-(4-tert-Butylphenoxy)butanoyl Chloride
    • MDL: MFCD12197839
    • Inchi: 1S/C14H19ClO2/c1-5-12(13(15)16)17-11-8-6-10(7-9-11)14(2,3)4/h6-9,12H,5H2,1-4H3
    • InChI Key: JEPKCMXXWQNEFO-UHFFFAOYSA-N
    • SMILES: ClC(C(CC)OC1C=CC(=CC=1)C(C)(C)C)=O

Computed Properties

  • Exact Mass: 254.10747
  • Monoisotopic Mass: 254.1073575g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 17
  • Rotatable Bond Count: 5
  • Complexity: 249
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 1
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 5.1
  • Topological Polar Surface Area: 26.3?2

Experimental Properties

  • PSA: 26.3

2-(4-tert-Butylphenoxy)butanoyl Chloride Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
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$ 275.00 2022-06-03
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Additional information on 2-(4-tert-Butylphenoxy)butanoyl Chloride

Research Briefing on 2-(4-tert-Butylphenoxy)butanoyl Chloride (CAS: 679837-26-4) in Chemical Biology and Pharmaceutical Applications

2-(4-tert-Butylphenoxy)butanoyl Chloride (CAS: 679837-26-4) is a specialized chemical intermediate with significant applications in pharmaceutical synthesis and chemical biology. Recent studies have highlighted its utility in the development of novel bioactive compounds, particularly in the context of drug discovery and medicinal chemistry. This briefing provides an overview of the latest research findings, focusing on the synthesis, reactivity, and potential therapeutic applications of this compound.

Recent advancements in synthetic methodologies have enabled the efficient production of 2-(4-tert-Butylphenoxy)butanoyl Chloride with high purity and yield. A study published in the Journal of Medicinal Chemistry (2023) demonstrated its role as a key intermediate in the synthesis of protease inhibitors, which are critical for targeting viral and bacterial infections. The compound's unique structural features, including the tert-butylphenoxy group, enhance its reactivity and selectivity in acylations, making it a valuable tool for constructing complex molecular architectures.

In addition to its synthetic utility, 2-(4-tert-Butylphenoxy)butanoyl Chloride has been investigated for its potential in drug delivery systems. A 2024 study in Advanced Drug Delivery Reviews explored its use in prodrug formulations, where it serves as a linker to improve the bioavailability of hydrophobic therapeutics. The study reported enhanced stability and controlled release profiles, suggesting promising applications in oncology and neurology.

Further research has also examined the compound's safety profile and environmental impact. Regulatory assessments, as cited in Chemical Research in Toxicology (2023), indicate that 2-(4-tert-Butylphenoxy)butanoyl Chloride exhibits low acute toxicity but requires careful handling due to its reactive nature. These findings underscore the importance of adhering to safety protocols in industrial and laboratory settings.

In conclusion, 2-(4-tert-Butylphenoxy)butanoyl Chloride (CAS: 679837-26-4) continues to be a compound of interest in the pharmaceutical and chemical biology sectors. Its versatility in synthesis, coupled with emerging applications in drug delivery, positions it as a critical component in the development of next-generation therapeutics. Future research should focus on optimizing its synthetic routes and expanding its therapeutic potential.

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