Cas no 57477-98-2 (Ethyl 3-(4-biphenyl)-3-oxopropanoate)

Ethyl 3-(4-biphenyl)-3-oxopropanoate structure
57477-98-2 structure
Product Name:Ethyl 3-(4-biphenyl)-3-oxopropanoate
CAS No:57477-98-2
MF:C17H16O3
MW:268.307145118713
CID:367256
PubChem ID:2756708
Update Time:2025-07-20

Ethyl 3-(4-biphenyl)-3-oxopropanoate Chemical and Physical Properties

Names and Identifiers

    • [1,1'-Biphenyl]-4-propanoicacid, b-oxo-, ethyl ester
    • 3-Biphenyl-4-yl-3-oxopropionic acid ethyl ester
    • 3-BIPHENYL-4-YL-3-OXO-PROPIONIC ACID ETHYL ESTER
    • ETHYL 3-(4-BIPHENYL) -3- OXOPROPANOATE
    • ethyl 3-oxo-3-(4-phenylphenyl)propanoate
    • AC-7797
    • b-Oxo-biphenyl-4-propanoic acid ethyl ester
    • ethyl 4-phenylbenzoylacetate
    • beta-Oxo-biphenyl-4-propanoic acid ethyl ester
    • ethyl 3-(4-biphenyl)-3-oxopropanoate
    • A831457
    • Ethyl 3-biphenyl-4-yl-3-oxopropionate
    • 57477-98-2
    • Ethyl3-([1,1'-biphenyl]-4-yl)-3-oxopropanoate
    • Ethyl 3-([1,1'-biphenyl]-4-yl)-3-oxopropanoate
    • 3-Biphenyl-4-yl-3-oxo-propionicacidethylester
    • CS-0319806
    • TQP1123
    • F78954
    • ETHYL 3-(BIPHENYL-4-YL)-3-OXOPROPANOATE
    • AKOS009260132
    • 3-oxo-3-(4-phenylphenyl)propanoic acid ethyl ester
    • MJCRLYUYIXGGAX-UHFFFAOYSA-N
    • BB 0257380
    • ethyl 3-oxidanylidene-3-(4-phenylphenyl)propanoate
    • SCHEMBL4270804
    • DTXSID40373487
    • Ethyl 3-(4-biphenyl)-3-oxopropanoate
    • MDL: MFCD03424803
    • Inchi: 1S/C17H16O3/c1-2-20-17(19)12-16(18)15-10-8-14(9-11-15)13-6-4-3-5-7-13/h3-11H,2,12H2,1H3
    • InChI Key: MJCRLYUYIXGGAX-UHFFFAOYSA-N
    • SMILES: O(CC)C(CC(C1C=CC(=CC=1)C1C=CC=CC=1)=O)=O

Computed Properties

  • Exact Mass: 268.11000
  • Monoisotopic Mass: 268.109944368g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 20
  • Rotatable Bond Count: 6
  • Complexity: 323
  • 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: 3.5
  • Topological Polar Surface Area: 43.4?2

Experimental Properties

  • PSA: 43.37000
  • LogP: 3.48950

Ethyl 3-(4-biphenyl)-3-oxopropanoate Customs Data

  • HS CODE:2918300090
  • Customs Data:

    China Customs Code:

    2918300090

    Overview:

    2918300090 Other aldehydes or ketones without other oxy carboxylic acids(Including anhydrides\Acyl halide\Peroxides, peroxyacids and derivatives of this tax number). VAT:17.0% Tax refund rate:9.0% Regulatory conditions:nothing MFN tariff:6.5% general tariff:30.0%

    Declaration elements:

    Product Name, component content, use to

    Summary:

    2918300090 other carboxylic acids with aldehyde or ketone function but without other oxygen function, their anhydrides, halides, peroxides, peroxyacids and their derivatives.Supervision conditions:None.VAT:17.0%.Tax rebate rate:9.0%.MFN tariff:6.5%.General tariff:30.0%

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Ethyl 3-(4-biphenyl)-3-oxopropanoate Suppliers

Amadis Chemical Company Limited
Gold Member
Audited Supplier Audited Supplier
(CAS:57477-98-2)Ethyl 3-(4-biphenyl)-3-oxopropanoate
Order Number:A831457
Stock Status:in Stock
Quantity:1g
Purity:99%
Pricing Information Last Updated:Monday, 2 September 2024 15:22
Price ($):213.0

Additional information on Ethyl 3-(4-biphenyl)-3-oxopropanoate

Recent Advances in the Study of Ethyl 3-(4-biphenyl)-3-oxopropanoate (CAS: 57477-98-2) and Its Applications in Chemical Biology and Pharmaceutical Research

Ethyl 3-(4-biphenyl)-3-oxopropanoate (CAS: 57477-98-2) is a β-keto ester derivative that has garnered significant attention in recent years due to its versatile applications in chemical biology and pharmaceutical research. This compound serves as a key intermediate in the synthesis of various bioactive molecules, including non-steroidal anti-inflammatory drugs (NSAIDs) and other pharmacologically active agents. Recent studies have explored its potential as a building block for the development of novel therapeutic compounds, particularly in the fields of oncology and inflammation.

One of the most notable advancements in the study of Ethyl 3-(4-biphenyl)-3-oxopropanoate is its role in the synthesis of biphenyl-based derivatives, which exhibit promising anti-inflammatory and anticancer properties. A 2023 study published in the Journal of Medicinal Chemistry demonstrated that derivatives of this compound could selectively inhibit cyclooxygenase-2 (COX-2), an enzyme implicated in inflammatory processes and cancer progression. The researchers utilized molecular docking and in vitro assays to validate the compound's efficacy, highlighting its potential as a lead structure for further drug development.

In addition to its pharmacological applications, Ethyl 3-(4-biphenyl)-3-oxopropanoate has also been investigated for its utility in chemical biology. A recent study in ACS Chemical Biology (2024) reported the use of this compound as a fluorescent probe for detecting reactive oxygen species (ROS) in cellular environments. The study revealed that the compound's unique chemical structure allows for selective interaction with ROS, making it a valuable tool for studying oxidative stress-related diseases such as neurodegenerative disorders and cancer.

Another area of active research involves the optimization of synthetic routes for Ethyl 3-(4-biphenyl)-3-oxopropanoate. A 2024 publication in Organic Process Research & Development detailed a novel, scalable synthesis method that improves yield and reduces environmental impact. The study emphasized the importance of green chemistry principles in the production of such intermediates, which aligns with the growing demand for sustainable pharmaceutical manufacturing practices.

Despite these advancements, challenges remain in the clinical translation of Ethyl 3-(4-biphenyl)-3-oxopropanoate-derived compounds. Issues such as bioavailability, metabolic stability, and potential off-target effects require further investigation. Ongoing research aims to address these limitations through structural modifications and advanced formulation strategies. For instance, a 2023 study in European Journal of Pharmaceutical Sciences explored the use of nanotechnology-based delivery systems to enhance the compound's therapeutic efficacy.

In conclusion, Ethyl 3-(4-biphenyl)-3-oxopropanoate (CAS: 57477-98-2) continues to be a focal point of research in chemical biology and pharmaceutical sciences. Its multifaceted applications—from drug development to chemical probes—underscore its significance in advancing both fundamental and translational research. Future studies will likely focus on overcoming existing challenges and expanding its utility in emerging therapeutic areas.

Recommended suppliers
Amadis Chemical Company Limited
(CAS:57477-98-2)Ethyl 3-(4-biphenyl)-3-oxopropanoate
A831457
Purity:99%
Quantity:1g
Price ($):213.0
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