Cas no 52298-32-5 (Acetic acid, (benzoyloxy)-, phenylmethyl ester)

Acetic acid, (benzoyloxy)-, phenylmethyl ester, also known as benzyl benzoyloxyacetate, is a chemical compound with the molecular formula C??H??O?. This ester derivative is characterized by its benzoyl and benzyl functional groups, which contribute to its reactivity and utility in organic synthesis. It is commonly employed as an intermediate in the production of pharmaceuticals, fragrances, and specialty chemicals. The compound exhibits stability under controlled conditions and offers selective reactivity for acyl transfer reactions. Its structural features make it suitable for applications requiring controlled esterification or transesterification processes. Proper handling and storage are recommended to maintain its integrity and performance in synthetic workflows.
Acetic acid, (benzoyloxy)-, phenylmethyl ester structure
52298-32-5 structure
Product Name:Acetic acid, (benzoyloxy)-, phenylmethyl ester
CAS No:52298-32-5
MF:C16H14O4
MW:270.279964923859
CID:359960
PubChem ID:69856316
Update Time:2025-06-11

Acetic acid, (benzoyloxy)-, phenylmethyl ester Chemical and Physical Properties

Names and Identifiers

    • Acetic acid, (benzoyloxy)-, phenylmethyl ester
    • (2-oxo-2-phenylmethoxyethyl) benzoate
    • SCHEMBL6662121
    • SY318760
    • 52298-32-5
    • MFCD25458405
    • (2-BEnzyloxy-2-oxoethyl)benzoate
    • DTXSID50741431
    • BENZYL 2-(BENZOYLOXY)ACETATE
    • 2-(Benzyloxy)-2-oxoethyl benzoate
    • Inchi: 1S/C16H14O4/c17-15(19-11-13-7-3-1-4-8-13)12-20-16(18)14-9-5-2-6-10-14/h1-10H,11-12H2
    • InChI Key: CHZHQRPANXDFMA-UHFFFAOYSA-N
    • SMILES: O(C(COC(C1C=CC=CC=1)=O)=O)CC1C=CC=CC=1

Computed Properties

  • Exact Mass: 270.08922
  • Monoisotopic Mass: 270.08920892g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 20
  • Rotatable Bond Count: 7
  • Complexity: 314
  • 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: 3.9
  • Topological Polar Surface Area: 52.6?2

Experimental Properties

  • PSA: 52.6

Acetic acid, (benzoyloxy)-, phenylmethyl ester Pricemore >>

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Additional information on Acetic acid, (benzoyloxy)-, phenylmethyl ester

Comprehensive Analysis of Acetic acid, (benzoyloxy)-, phenylmethyl ester (CAS No. 52298-32-5)

Acetic acid, (benzoyloxy)-, phenylmethyl ester, identified by its CAS No. 52298-32-5, is a specialized organic compound widely utilized in pharmaceutical and cosmetic formulations. This ester derivative combines acetic acid and benzoyl functionalities, offering unique chemical properties that make it valuable for controlled-release applications and fragrance stabilization. Its molecular structure, C16H14O4, features a phenylmethyl ester group, which enhances its solubility in organic solvents—a critical factor for industrial processing.

Recent trends in green chemistry have spurred interest in optimizing the synthesis of Acetic acid, (benzoyloxy)-, phenylmethyl ester to reduce environmental impact. Researchers are exploring enzymatic catalysis as an alternative to traditional methods, addressing concerns about energy consumption and waste generation. This aligns with the growing demand for sustainable esterification processes, a topic frequently searched in academic and industrial databases.

In cosmetic science, this compound is gaining attention for its potential as a mild preservative enhancer. Unlike conventional parabens, it exhibits lower skin irritation profiles while maintaining efficacy against microbial growth—a feature highlighted in recent dermatology-focused forums. Formulators are increasingly combining it with natural antioxidants to create synergistic stabilization systems, responding to consumer preferences for "clean-label" products.

The pharmaceutical industry employs CAS No. 52298-32-5 as a prodrug intermediate, particularly in developing targeted drug delivery systems. Its ability to undergo controlled hydrolysis under physiological conditions makes it ideal for pH-sensitive release formulations—a hot topic in nanomedicine research. Recent patent filings reveal innovative applications in ophthalmic preparations, where its slow degradation kinetics improve therapeutic duration.

Analytical characterization of this compound typically involves HPLC-UV and GC-MS techniques, with particular emphasis on purity assessment. Regulatory guidelines from ICH Q3D require stringent control of residual solvents in its production—a compliance aspect heavily discussed in quality assurance circles. Advanced techniques like 2D NMR are now being applied to study its conformational behavior in different solvent systems.

From a commercial perspective, Acetic acid, (benzoyloxy)-, phenylmethyl ester has seen steady demand growth in Asia-Pacific markets, driven by expansion in specialty chemicals manufacturing. Suppliers are increasingly offering GMP-grade batches to meet pharmaceutical standards, while technical-grade material remains popular for industrial applications. Market analysts note its inclusion in several high-value chemical portfolios as a niche performance additive.

Emerging research explores its potential in biodegradable polymer modification, where its aromatic components may enhance material properties without compromising environmental safety. This application resonates with current searches for eco-friendly plasticizers and aligns with circular economy principles. Studies suggest its metabolites show favorable environmental persistence profiles compared to traditional phthalate alternatives.

Storage and handling recommendations emphasize protection from UV degradation, with amber glass containers being the preferred packaging solution. Thermal stability studies indicate safe processing below 150°C, making it compatible with standard hot-melt manufacturing equipment—a practical consideration frequently queried by process engineers. Proper ventilation controls are advised during large-scale operations to maintain workplace safety standards.

In conclusion, CAS No. 52298-32-5 represents a versatile chemical building block whose applications continue to expand across multiple industries. Its evolving role in sustainable formulation strategies and advanced drug delivery systems positions it as a compound of ongoing scientific and commercial interest, warranting continued research into its optimization and novel applications.

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