Cas no 191346-50-6 (2-(4-Fluorophenyl)-1-p-tolylethanone)

2-(4-Fluorophenyl)-1-p-tolylethanone is a fluorinated aromatic ketone compound with a molecular structure featuring both a 4-fluorophenyl and a p-tolyl group. This compound is of interest in organic synthesis and pharmaceutical research due to its potential as a versatile intermediate. The presence of the fluorine atom enhances its reactivity and stability, making it suitable for further functionalization in cross-coupling reactions or as a precursor in the synthesis of bioactive molecules. Its well-defined crystalline structure ensures consistent purity, which is critical for reproducibility in research applications. The compound’s balanced lipophilicity and electronic properties contribute to its utility in medicinal chemistry and material science.
2-(4-Fluorophenyl)-1-p-tolylethanone structure
191346-50-6 structure
Product Name:2-(4-Fluorophenyl)-1-p-tolylethanone
CAS No:191346-50-6
MF:C15H13FO
MW:228.261527776718
CID:115986
PubChem ID:1512678
Update Time:2025-10-31

2-(4-Fluorophenyl)-1-p-tolylethanone Chemical and Physical Properties

Names and Identifiers

    • Ethylidene,1-(4-fluorophenyl)-2-(4-methylphenyl)-2-oxo- (9CI)
    • 2-(4-Fluorophenyl)-1-(4-methylphenyl)ethanone
    • 2-(4-Fluorophenyl)-1-(p-tolyl)ethanone
    • 2‐(4‐FLUOROPHENYL)‐1‐P‐TOLYL‐ETHANONE
    • EN300-187046
    • starbld0023243
    • 191346-50-6
    • 2-(4-Fluorophenyl)-1-p-tolyl-ethanone
    • 2-(4-fluorophenyl)-1-p-tolylethanone
    • 2-(4-Fluorophenyl)-1-(p-tolyl)ethan-1-one
    • MFCD03788454
    • 2-(4-fluorophenyl)-1-(4-methylphenyl)ethan-1-one
    • 684270-36-8
    • 2-(4-Fluorophenyl)-1-p-tolylethanone
    • Inchi: 1S/C15H13FO/c1-11-2-6-13(7-3-11)15(17)10-12-4-8-14(16)9-5-12/h2-9H,10H2,1H3
    • InChI Key: ZVXZTZFHRJQQCQ-UHFFFAOYSA-N
    • SMILES: FC1C=CC(=CC=1)CC(C1C=CC(C)=CC=1)=O

Computed Properties

  • Exact Mass: 228.09509
  • Monoisotopic Mass: 228.095
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 17
  • Rotatable Bond Count: 3
  • Complexity: 248
  • 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: 3.6
  • Topological Polar Surface Area: 17.1?2

Experimental Properties

  • PSA: 17.07

2-(4-Fluorophenyl)-1-p-tolylethanone Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
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2-(4-Fluorophenyl)-1-p-tolylethanone Related Literature

Additional information on 2-(4-Fluorophenyl)-1-p-tolylethanone

2-(4-Fluorophenyl)-1-p-tolylethanone: A Comprehensive Overview

The compound 2-(4-Fluorophenyl)-1-p-tolylethanone, identified by the CAS number 191346-50-6, is a significant molecule in the field of organic chemistry. This compound is characterized by its unique structure, which combines a fluorophenyl group and a p-tolyl group attached to an ethanone backbone. The fluorophenyl group introduces electronic effects that influence the compound's reactivity and stability, while the p-tolyl group contributes to its aromaticity and potential applications in various chemical reactions.

Recent studies have highlighted the importance of 2-(4-Fluorophenyl)-1-p-tolylethanone in medicinal chemistry. Researchers have explored its role as a precursor in the synthesis of bioactive compounds, particularly those with potential anti-inflammatory and antioxidant properties. The ethanone functional group serves as a versatile platform for further chemical modifications, enabling the creation of derivatives with enhanced biological activity.

In terms of synthesis, 2-(4-Fluorophenyl)-1-p-tolylethanone can be prepared through a variety of methods, including Friedel-Crafts acylation and nucleophilic aromatic substitution. These methods leverage the reactivity of the fluorine atom in the fluorophenyl group, which facilitates electrophilic substitution reactions. The p-tolyl group also plays a crucial role in directing these reactions, ensuring high yields and selectivity.

The physical properties of 2-(4-Fluorophenyl)-1-p-tolylethanone are well-documented. It has a melting point of approximately 85°C and is soluble in common organic solvents such as dichloromethane and ethyl acetate. Its UV-Vis spectrum shows strong absorption bands due to the conjugated aromatic system, making it suitable for applications in optoelectronics and materials science.

From an environmental perspective, 2-(4-Fluorophenyl)-1-p-tolylethanone has been studied for its biodegradation potential. Research indicates that under aerobic conditions, the compound undergoes microbial degradation, primarily through oxidative pathways. This understanding is critical for assessing its environmental impact and ensuring sustainable practices in its production and use.

In conclusion, 2-(4-Fluorophenyl)-1-p-tolylethanone (CAS No: 191346-50-6) is a versatile compound with wide-ranging applications in organic synthesis, medicinal chemistry, and materials science. Its unique structure and reactivity make it an invaluable tool for researchers seeking to develop novel chemical entities with enhanced functionality.

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