Cas no 14062-26-1 (Ethyl 2-(4-phenoxyphenyl)acetate)

Ethyl 2-(4-phenoxyphenyl)acetate is a versatile organic compound, characterized by its aromatic structure and functional group. It exhibits high purity and stability, making it suitable for various chemical syntheses. This compound offers advantages such as excellent solubility in organic solvents and potential for forming stable esters, contributing to its utility in pharmaceutical and material science applications.
Ethyl 2-(4-phenoxyphenyl)acetate structure
14062-26-1 structure
Product Name:Ethyl 2-(4-phenoxyphenyl)acetate
CAS No:14062-26-1
MF:C16H16O3
MW:256.296444892883
MDL:MFCD12828046
CID:105648
PubChem ID:13567666
Update Time:2025-06-18

Ethyl 2-(4-phenoxyphenyl)acetate Chemical and Physical Properties

Names and Identifiers

    • Ethyl 2-(4-phenoxyphenyl)acetate
    • LogP
    • Acetic acid, (p-phenoxyphenyl)-, ethyl ester
    • Benzeneacetic acid, 4-phenoxy-, ethyl ester
    • SY043384
    • Ethyl (4-phenoxyphenyl)acetate
    • Ethyl 4-phenoxyphenylacetate
    • FT-0689894
    • SCHEMBL11244931
    • 14062-26-1
    • Ethyl2-(4-phenoxyphenyl)acetate
    • CPYLMUNOJSVCRZ-UHFFFAOYSA-N
    • AKOS015900137
    • AS-10459
    • Benzeneacetic acid,4-phenoxy-,ethyl ester
    • Ethyl (4'-phenoxyphenyl)acetate
    • A911137
    • Q63392402
    • CS-0061618
    • DTXSID10544001
    • N10612
    • MFCD12828046
    • MDL: MFCD12828046
    • Inchi: 1S/C16H16O3/c1-2-18-16(17)12-13-8-10-15(11-9-13)19-14-6-4-3-5-7-14/h3-11H,2,12H2,1H3
    • InChI Key: CPYLMUNOJSVCRZ-UHFFFAOYSA-N
    • SMILES: O(C1C=CC=CC=1)C1C=CC(=CC=1)CC(=O)OCC

Computed Properties

  • Exact Mass: 256.10998
  • Monoisotopic Mass: 256.109944368g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 19
  • Rotatable Bond Count: 6
  • Complexity: 263
  • 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: 3.8
  • Topological Polar Surface Area: 35.5?2

Experimental Properties

  • Density: 1.117
  • Boiling Point: 353.8 ℃ at 760 mmHg
  • Flash Point: 147.3°C
  • Refractive Index: 1.552
  • PSA: 35.53

Ethyl 2-(4-phenoxyphenyl)acetate Pricemore >>

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Additional information on Ethyl 2-(4-phenoxyphenyl)acetate

Ethyl 2-(4-phenoxyphenyl)acetate: Chemical Profile and Emerging Applications

Ethyl 2-(4-phenoxyphenyl)acetate, with the CAS number 14062-26-1, is a significant compound in the realm of organic chemistry and pharmaceutical research. This ester derivative, characterized by its phenolic and acetic functional groups, has garnered attention due to its versatile structural properties and potential applications in medicinal chemistry. The compound's molecular structure, featuring a phenoxyl group linked to an acetic acid moiety via an ethyl ester bridge, positions it as a valuable scaffold for further chemical modifications and biological evaluations.

The synthesis of Ethyl 2-(4-phenoxyphenyl)acetate typically involves the reaction between 4-phenoxybenzoic acid and ethanol under acidic conditions, facilitated by catalysts such as sulfuric acid or p-toluenesulfonic acid. This process yields the ethyl ester derivative with high yield and purity, making it accessible for subsequent derivatization. The compound's stability under various reaction conditions further enhances its utility in synthetic protocols.

In recent years, Ethyl 2-(4-phenoxyphenyl)acetate has been explored for its pharmacological potential. Its structural motif is reminiscent of several bioactive molecules, prompting investigations into its effects on biological targets. Preliminary studies have indicated that this compound may exhibit properties relevant to anti-inflammatory and analgesic mechanisms. The phenoxyl group, in particular, is known to interact with various enzymes and receptors, suggesting a broad spectrum of biological activity.

One of the most intriguing aspects of Ethyl 2-(4-phenoxyphenyl)acetate is its role as a precursor in the development of novel therapeutic agents. Researchers have leveraged its scaffold to design derivatives with enhanced pharmacokinetic profiles and improved target specificity. For instance, modifications at the ester linkage have been investigated to modulate metabolic stability, while alterations at the phenolic ring have aimed to optimize binding affinity to therapeutic targets.

The compound's relevance extends beyond pharmaceutical applications; it has also been utilized in agrochemical research. Its structural features make it a candidate for developing novel pesticides or herbicides, where similar phenolic esters are known to interfere with metabolic pathways in pests. This dual utility underscores the importance of Ethyl 2-(4-phenoxyphenyl)acetate as a versatile chemical entity.

Advances in computational chemistry have further propelled the study of Ethyl 2-(4-phenoxyphenyl)acetate. Molecular modeling techniques have been employed to predict its interactions with biological targets, providing insights into potential drug-like properties. These simulations have guided experimental efforts, enabling more targeted synthesis of derivatives with desired characteristics.

The environmental impact of Ethyl 2-(4-phenoxyphenyl)acetate has also been a point of interest. Studies have assessed its degradation pathways and ecotoxicological profile under various environmental conditions. Such evaluations are crucial for ensuring that its use does not pose undue risks to ecosystems. Efforts are ongoing to develop sustainable synthetic routes that minimize environmental footprint while maintaining high yields and purity.

Future directions in the research of Ethyl 2-(4-phenoxyphenyl)acetate include exploring its role in nanotechnology and material science. The compound's ability to form inclusion complexes with other molecules makes it a candidate for drug delivery systems. Additionally, its interactions with metal ions suggest potential applications in catalysis or as a ligand in coordination chemistry.

In conclusion, Ethyl 2-(4-phenoxyphenyl)acetate (CAS no: 14062-26-1) represents a multifaceted compound with significant implications across multiple scientific disciplines. Its structural versatility, coupled with emerging research findings, positions it as a cornerstone in organic synthesis and pharmaceutical development. As our understanding of its properties continues to evolve, so too will its applications in medicine, agriculture, and beyond.

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