Cas no 88607-79-8 (E-3-(4-Benzyloxy)-1-(2.4-bisbenzyloxy-6-hydroxy)phenyl)propenone)

E-3-(4-Benzyloxy)-1-(2,4-bisbenzyloxy-6-hydroxyphenyl)propenone is a synthetic chalcone derivative characterized by its benzyl-protected phenolic hydroxyl groups and α,β-unsaturated ketone moiety. This compound exhibits notable stability due to the benzyl ether protecting groups, which enhance its suitability for organic synthesis and intermediate applications. The conjugated enone system contributes to its potential reactivity in Michael additions or cyclization reactions, making it valuable for constructing complex heterocyclic frameworks. Its structural features also suggest utility in photophysical studies or as a precursor for bioactive molecules. The product is typically handled under inert conditions to preserve its integrity, ensuring consistent performance in research and development settings.
E-3-(4-Benzyloxy)-1-(2.4-bisbenzyloxy-6-hydroxy)phenyl)propenone structure
88607-79-8 structure
Product Name:E-3-(4-Benzyloxy)-1-(2.4-bisbenzyloxy-6-hydroxy)phenyl)propenone
CAS No:88607-79-8
MF:C36H30O5
MW:542.620410442352
CID:626815
PubChem ID:13396916
Update Time:2025-05-23

E-3-(4-Benzyloxy)-1-(2.4-bisbenzyloxy-6-hydroxy)phenyl)propenone Chemical and Physical Properties

Names and Identifiers

    • 2-Propen-1-one,1-[2-hydroxy-4,6-bis(phenylmethoxy)phenyl]-3-[4-(phenylmethoxy)phenyl]-, (E)-
    • E-3-(4-Benzyloxy)-1-(2.4-bisbenzyloxy-6-hydroxy)phenyl)propenone
    • (E)-1-(2,4-bis(benzyloxy)-6-hydroxyphenyl)-3-(4-(benzyloxy)phenyl)prop-2-en-1-one
    • (E)-1-[2-hydroxy-4,6-bis(phenylmethoxy)phenyl]-3-(4-phenylmethoxyphenyl)prop-2-en-1-one
    • SCHEMBL13657210
    • SCHEMBL4883627
    • 88607-79-8
    • Inchi: 1S/C36H30O5/c37-33(21-18-27-16-19-31(20-17-27)39-24-28-10-4-1-5-11-28)36-34(38)22-32(40-25-29-12-6-2-7-13-29)23-35(36)41-26-30-14-8-3-9-15-30/h1-23,38H,24-26H2/b21-18+
    • InChI Key: POBAJWKYWOQRCS-DYTRJAOYSA-N
    • SMILES: O(CC1C=CC=CC=1)C1=CC(=CC(=C1C(/C=C/C1C=CC(=CC=1)OCC1C=CC=CC=1)=O)O)OCC1C=CC=CC=1

Computed Properties

  • Exact Mass: 542.20900
  • Monoisotopic Mass: 542.20932405g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 5
  • Heavy Atom Count: 41
  • Rotatable Bond Count: 12
  • Complexity: 771
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 1
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 8.3
  • Topological Polar Surface Area: 65?2

Experimental Properties

  • Melting Point: 127-129°C
  • Solubility: Dichloromethane, Methanol
  • PSA: 64.99000
  • LogP: 8.02530

E-3-(4-Benzyloxy)-1-(2.4-bisbenzyloxy-6-hydroxy)phenyl)propenone Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
TRC
B287640-10mg
E-3-(4-Benzyloxy)-1-(2.4-bisbenzyloxy-6-hydroxy)phenyl)propenone
88607-79-8
10mg
$ 150.00 2023-04-18
TRC
B287640-25mg
E-3-(4-Benzyloxy)-1-(2.4-bisbenzyloxy-6-hydroxy)phenyl)propenone
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$ 190.00 2023-04-18
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B287640-50mg
E-3-(4-Benzyloxy)-1-(2.4-bisbenzyloxy-6-hydroxy)phenyl)propenone
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$ 356.00 2023-04-18
TRC
B287640-100mg
E-3-(4-Benzyloxy)-1-(2.4-bisbenzyloxy-6-hydroxy)phenyl)propenone
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100mg
$ 678.00 2023-04-18
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E-3-(4-Benzyloxy)-1-(2.4-bisbenzyloxy-6-hydroxy)phenyl)propenone
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Additional information on E-3-(4-Benzyloxy)-1-(2.4-bisbenzyloxy-6-hydroxy)phenyl)propenone

E-3-(4-Benzyloxy)-1-(2.4-bisbenzyloxy-6-hydroxy)phenyl)propenone: A Comprehensive Overview

E-3-(4-Benzyloxy)-1-(2.4-bisbenzyloxy-6-hydroxy)phenyl)propenone, commonly referenced by its CAS number 88607-79-8, is a complex organic compound with significant potential in various chemical and pharmaceutical applications. This compound is characterized by its intricate structure, which includes a propenone moiety attached to a phenyl group substituted with multiple benzyl ether groups and a hydroxyl group. The presence of these functional groups renders the compound highly versatile, making it a valuable intermediate in the synthesis of advanced organic molecules.

The benzyl ether groups in the structure are particularly notable, as they contribute to the compound's stability and reactivity. Recent studies have highlighted the importance of such ether functionalities in facilitating specific types of chemical reactions, such as nucleophilic substitutions and oxidations. Furthermore, the hydroxyl group present in the molecule plays a crucial role in determining its solubility properties and its ability to form hydrogen bonds, which are essential for many biological interactions.

Recent advancements in synthetic chemistry have enabled the precise control of stereochemistry during the synthesis of E-3-(4-Benzyloxy)-1-(2.4-bisbenzyloxy-6-hydroxy)phenyl)propenone. This has led to the development of enantioselective methods that allow for the production of high-purity enantiomers, which are critical for applications in drug discovery and development. The ability to control stereochemistry not only enhances the quality of the final product but also opens up new avenues for exploring its biological activity.

In terms of applications, E-3-(4-Benzyloxy)-1-(2.4-bisbenzyloxy-6-hydroxy)phenyl)propenone has shown promise in the field of medicinal chemistry. Its structure resembles certain natural products, suggesting that it could serve as a lead compound for designing novel therapeutic agents. For instance, research has demonstrated that derivatives of this compound exhibit potent anti-inflammatory and antioxidant properties, making them potential candidates for treating conditions such as neurodegenerative diseases and cardiovascular disorders.

The synthesis of E-3-(4-Benzyloxy)-1-(2.4-bisbenzyloxy-6-hydroxy)phenyl)propenone typically involves multi-step processes that require careful optimization. One common approach involves the use of palladium-catalyzed coupling reactions to assemble the aromatic framework, followed by selective oxidation steps to introduce the propenone functionality. These methods have been refined over time to improve yield and reduce reaction times, making them more practical for large-scale production.

From an environmental perspective, there is growing interest in developing sustainable methods for synthesizing compounds like E-3-(4-Benzyloxy)-1-(2.4-bisbenzyloxy-6-hydroxy)phenyl)propenone. Researchers are exploring green chemistry approaches that utilize renewable feedstocks and minimize waste generation. For example, catalytic hydrogenation techniques using biodegradable catalysts have been proposed as eco-friendly alternatives to traditional methods.

In conclusion, E-3-(4-Benzyloxy)-1-(2.4-bisbenzyloxy-6-hydroxy)phenyl)propenone (CAS No: 88607-79-8) stands out as a versatile and valuable compound with wide-ranging applications in organic synthesis and drug development. Its unique structure and functional groups make it an ideal candidate for exploring novel chemical transformations and biological activities. As research continues to uncover new insights into its properties and potential uses, this compound is likely to play an increasingly important role in advancing modern chemistry.

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