Cas no 1261910-60-4 (4-(2-Chloro-4-ethoxyphenyl)phenol)

4-(2-Chloro-4-ethoxyphenyl)phenol is a chlorinated and ethoxylated biphenyl derivative with potential applications as an intermediate in organic synthesis, particularly in the development of specialty chemicals and pharmaceuticals. Its unique structure, featuring both chloro and ethoxy substituents on the phenyl rings, offers reactivity suitable for further functionalization, making it valuable in fine chemical manufacturing. The compound exhibits stability under standard conditions, ensuring consistent performance in synthetic processes. Its well-defined molecular framework allows for precise modifications, enabling tailored applications in agrochemicals, dyes, or advanced material precursors. The presence of both electron-withdrawing and electron-donating groups enhances its versatility in cross-coupling and substitution reactions.
4-(2-Chloro-4-ethoxyphenyl)phenol structure
1261910-60-4 structure
Product Name:4-(2-Chloro-4-ethoxyphenyl)phenol
CAS No:1261910-60-4
MF:C14H13ClO2
MW:248.704823255539
MDL:MFCD18312985
CID:2762897
PubChem ID:53218682
Update Time:2025-05-19

4-(2-Chloro-4-ethoxyphenyl)phenol Chemical and Physical Properties

Names and Identifiers

    • MFCD18312985
    • 2'-Chloro-4'-ethoxy-[1,1'-biphenyl]-4-ol
    • CS-0209376
    • 4-(2-CHLORO-4-ETHOXYPHENYL)PHENOL
    • DTXSID00683599
    • 2'-Chloro-4'-ethoxy[1,1'-biphenyl]-4-ol
    • BS-30483
    • 1261910-60-4
    • 4-(2-Chloro-4-ethoxyphenyl)phenol
    • MDL: MFCD18312985
    • Inchi: 1S/C14H13ClO2/c1-2-17-12-7-8-13(14(15)9-12)10-3-5-11(16)6-4-10/h3-9,16H,2H2,1H3
    • InChI Key: ANKIOAYESUDKNX-UHFFFAOYSA-N
    • SMILES: ClC1C=C(C=CC=1C1C=CC(=CC=1)O)OCC

Computed Properties

  • Exact Mass: 248.0604073Da
  • Monoisotopic Mass: 248.0604073Da
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 17
  • Rotatable Bond Count: 3
  • Complexity: 226
  • 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: 4.3
  • Topological Polar Surface Area: 29.5?2

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Additional information on 4-(2-Chloro-4-ethoxyphenyl)phenol

4-(2-Chloro-4-Ethoxyphenyl)Phenol: A Comprehensive Overview

4-(2-Chloro-4-Ethoxyphenyl)Phenol, also known by its CAS number 1261910-60-4, is a versatile organic compound with significant applications in various fields of chemistry. This compound, characterized by its unique structure, has garnered attention due to its potential in drug discovery, material science, and environmental chemistry. Recent advancements in synthetic methodologies and computational modeling have further enhanced our understanding of its properties and functionalities.

The molecular structure of 4-(2-Chloro-4-Ethoxyphenyl)Phenol comprises a phenol group attached to a substituted benzene ring. The substituents on the benzene ring include a chlorine atom at the 2-position and an ethoxy group at the 4-position. This arrangement imparts distinct electronic and steric properties to the molecule, making it suitable for various chemical reactions. The phenol group, being highly reactive, plays a pivotal role in determining the compound's reactivity and selectivity in different chemical environments.

Recent studies have explored the synthesis of 4-(2-Chloro-4-Ethoxyphenyl)Phenol through innovative routes, leveraging both traditional organic synthesis techniques and modern catalytic processes. Researchers have demonstrated that the compound can be synthesized via nucleophilic aromatic substitution or through coupling reactions, depending on the desired regioselectivity and yield. These methods have been optimized to minimize side reactions and improve overall efficiency, making large-scale production more feasible.

In terms of applications, 4-(2-Chloro-4-Ethoxyphenyl)Phenol has shown promise in the field of pharmacology. Its ability to act as a precursor in drug synthesis has been highlighted in recent publications. For instance, studies have shown that derivatives of this compound exhibit potent anti-inflammatory and antioxidant properties, making them potential candidates for therapeutic agents. Additionally, its role as an intermediate in the synthesis of more complex molecules has been explored, further expanding its utility in medicinal chemistry.

The environmental impact of 4-(2-Chloro-4-Ethoxyphenyl)Phenol has also been a topic of interest. Researchers have investigated its biodegradability under various conditions and its potential toxicity to aquatic organisms. Findings suggest that while the compound exhibits moderate biodegradability, its environmental fate depends significantly on the specific conditions under which it is released into the environment. These studies underscore the importance of responsible handling and disposal practices to mitigate any adverse effects on ecosystems.

In conclusion, 4-(2-Chloro-4-Ethoxyphenyl)Phenol, with its CAS number 1261910-60-4, stands as a significant compound in contemporary chemistry. Its unique structure, versatile reactivity, and wide-ranging applications make it an area of continued research interest. As advancements in synthetic methods and computational modeling continue to evolve, our understanding of this compound's potential will undoubtedly expand further.

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