Cas no 10420-97-0 (1-(4-Methoxyphenyl)-2-(pyridin-2-yl)ethan-1-one)

1-(4-Methoxyphenyl)-2-(pyridin-2-yl)ethan-1-one is a versatile organic compound featuring a methoxyphenyl and pyridinyl moiety, making it valuable in synthetic chemistry and pharmaceutical research. Its structure combines aromatic and heterocyclic components, enabling applications as an intermediate in the synthesis of bioactive molecules, including potential drug candidates. The presence of both electron-donating (methoxy) and electron-withdrawing (pyridinyl) groups enhances its reactivity in cross-coupling and condensation reactions. This compound exhibits favorable solubility in common organic solvents, facilitating its use in laboratory-scale reactions. Its well-defined molecular architecture also makes it suitable for mechanistic studies and structure-activity relationship (SAR) investigations. High purity grades are available to ensure reproducibility in research applications.
1-(4-Methoxyphenyl)-2-(pyridin-2-yl)ethan-1-one structure
10420-97-0 structure
Product Name:1-(4-Methoxyphenyl)-2-(pyridin-2-yl)ethan-1-one
CAS No:10420-97-0
MF:C14H13NO2
MW:227.258523702621
MDL:MFCD11188615
CID:173577
PubChem ID:238350
Update Time:2025-06-07

1-(4-Methoxyphenyl)-2-(pyridin-2-yl)ethan-1-one Chemical and Physical Properties

Names and Identifiers

    • Ethanone,1-(4-methoxyphenyl)-2-(2-pyridinyl)-
    • 1-(4-methoxyphenyl)-2-pyridin-2-ylethanone
    • 1-(4-methoxyphenyl)-2-(2-pyridinyl)ethanone
    • 1-(4-METHOXYPHENYL)-2-(2-PYRIDYL)ETHANONE
    • 1-(4-methoxyphenyl)-2-(pyridin-2-yl)ethanone
    • 1-(4-Methoxy-phenyl)-2-[2]pyridyl-aethanon
    • 1-(4-methoxy-phenyl)-2-[2]pyridyl-ethanone
    • 2-(4-Methoxy-phenacyl)-pyridin
    • AC1L60SB
    • AC1Q5EH8
    • CTK4A2850
    • KST-1A9912
    • NSC42682
    • Oprea1_115266
    • SureCN6283263
    • EN300-208091
    • 10420-97-0
    • NSC-42682
    • CHEMBL4993678
    • 1-(4-methoxyphenyl)-2-(pyridin-2-yl)ethan-1-one
    • CS-0239235
    • Z361879486
    • AKOS006033263
    • SCHEMBL6283263
    • DTXSID70285721
    • 1-(4-Methoxyphenyl)-2-(pyridin-2-yl)ethan-1-one
    • MDL: MFCD11188615
    • Inchi: 1S/C14H13NO2/c1-17-13-7-5-11(6-8-13)14(16)10-12-4-2-3-9-15-12/h2-9H,10H2,1H3
    • InChI Key: YDDIGUFGIDJEEM-UHFFFAOYSA-N
    • SMILES: O(C)C1C=CC(=CC=1)C(CC1C=CC=CN=1)=O

Computed Properties

  • Exact Mass: 227.09469
  • Monoisotopic Mass: 227.095
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 17
  • Rotatable Bond Count: 4
  • Complexity: 247
  • 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: 2.1
  • Topological Polar Surface Area: 39.2?2

Experimental Properties

  • Density: 1.142
  • Boiling Point: 390.6°Cat760mmHg
  • Flash Point: 190.1°C
  • Refractive Index: 1.573
  • PSA: 39.19
  • LogP: 2.51560

1-(4-Methoxyphenyl)-2-(pyridin-2-yl)ethan-1-one Pricemore >>

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Additional information on 1-(4-Methoxyphenyl)-2-(pyridin-2-yl)ethan-1-one

1-(4-Methoxyphenyl)-2-(pyridin-2-yl)ethan-1-one: A Comprehensive Overview

The compound 1-(4-Methoxyphenyl)-2-(pyridin-2-yl)ethan-1-one, identified by the CAS number 10420-97-0, is a significant molecule in the field of organic chemistry. This compound is characterized by its unique structure, which combines a methoxyphenyl group and a pyridinyl group, connected through a ketone functional group. The molecule's structure not only imparts it with interesting chemical properties but also positions it as a valuable intermediate in various synthetic processes.

The synthesis of 1-(4-Methoxyphenyl)-2-(pyridin-2-yl)ethan-1-one involves a series of well-established organic reactions. One common approach is the Friedel-Crafts acylation, where the methoxyphenyl ring undergoes acylation to form the ketone moiety. This reaction is typically carried out in the presence of a Lewis acid catalyst, such as aluminum chloride, to facilitate the acylation process. The resulting intermediate is then subjected to further reactions to introduce the pyridinyl group at the appropriate position. Recent advancements in catalytic systems have enabled more efficient and selective synthesis routes, reducing side reactions and improving yield.

The chemical properties of 1-(4-Methoxyphenyl)-2-(pyridin-2-yl)ethan-1-one are heavily influenced by its functional groups. The methoxy group on the phenyl ring introduces electron-donating effects, which can modulate the reactivity of the molecule in various reactions. The pyridinyl group, on the other hand, contributes aromatic stability and can participate in hydrogen bonding or other non-covalent interactions. These properties make the compound versatile in applications ranging from pharmaceuticals to agrochemicals.

In recent years, there has been growing interest in exploring the biological activities of 1-(4-Methoxyphenyl)-2-(pyridin-2-yl)ethan-1-one. Studies have shown that this compound exhibits potential anti-inflammatory and antioxidant properties, making it a promising candidate for drug development. Researchers have also investigated its role as a precursor in the synthesis of bioactive molecules, leveraging its structural features to design more complex compounds with enhanced pharmacological profiles.

The application of computational chemistry tools has further enhanced our understanding of this compound's behavior. Molecular docking studies have revealed that 1-(4-Methoxyphenyl)-2-(pyridin-2-yl)ethan-1-one can interact with key biological targets, such as enzymes involved in inflammatory pathways. These findings underscore its potential as a lead compound for developing novel therapeutic agents.

In terms of industrial applications, 1-(4-Methoxyphenyl)-2-(pyridin-2-yl)ethan-1-one is widely used as an intermediate in the synthesis of various organic compounds. Its ability to undergo nucleophilic addition reactions makes it particularly useful in the production of fine chemicals and specialty materials. The compound's stability under standard reaction conditions also contributes to its desirability in large-scale manufacturing processes.

The environmental impact of synthesizing and using 1-(4-Methoxyphenyl)-2-(pyridin-2-yl)ethan-1-one has been a topic of recent research. Efforts are being made to develop greener synthesis routes that minimize waste and reduce energy consumption. For instance, catalytic systems based on renewable resources are being explored to replace traditional metal catalysts, aligning with sustainability goals.

In conclusion, 1-(4-Methoxyphenyl)-2-(pyridin-2-y l)ethan 1-one, CAS number 04 , is a multifaceted compound with significant implications across various fields of chemistry. Its unique structure, versatile reactivity, and promising biological activities position it as an essential molecule for both academic research and industrial applications. As research continues to uncover new aspects of this compound's properties and applications, its role in advancing chemical science is expected to grow even further.

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