Cas no 790257-33-9 (Ethanone, 1-[9,10-bis(bromomethyl)-2-anthracenyl]-)

Ethanone, 1-[9,10-bis(bromomethyl)-2-anthracenyl]- structure
790257-33-9 structure
Product Name:Ethanone, 1-[9,10-bis(bromomethyl)-2-anthracenyl]-
CAS No:790257-33-9
MF:C18H14Br2O
MW:406.11116361618
MDL:MFCD32068444
CID:1798067
PubChem ID:23109536
Update Time:2025-07-21

Ethanone, 1-[9,10-bis(bromomethyl)-2-anthracenyl]- Chemical and Physical Properties

Names and Identifiers

    • Ethanone, 1-[9,10-bis(bromomethyl)-2-anthracenyl]-
    • Ethanone,1-[9,10-bis(bromomethyl)-2-anthracenyl]-
    • 1-[9,10-Bis(bromomethyl)-2-anthracenyl]ethanone
    • 790257-33-9
    • 1-[9,10-bis(bromomethyl)anthracen-2-yl]ethanone
    • SCHEMBL975276
    • SY253395
    • AC9227
    • MFCD32068444
    • 1-(9,10-Bis(bromomethyl)anthracen-2-yl)ethanone
    • MDL: MFCD32068444
    • Inchi: 1S/C18H14Br2O/c1-11(21)12-6-7-15-16(8-12)18(10-20)14-5-3-2-4-13(14)17(15)9-19/h2-8H,9-10H2,1H3
    • InChI Key: FADLMGMYEZTIIY-UHFFFAOYSA-N
    • SMILES: BrCC1C2C=CC=CC=2C(CBr)=C2C=CC(C(C)=O)=CC2=1

Computed Properties

  • Exact Mass: 405.93909g/mol
  • Monoisotopic Mass: 403.94114g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 1
  • Heavy Atom Count: 21
  • Rotatable Bond Count: 3
  • Complexity: 383
  • 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: 5.2
  • Topological Polar Surface Area: 17.1?2

Ethanone, 1-[9,10-bis(bromomethyl)-2-anthracenyl]- Pricemore >>

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Additional information on Ethanone, 1-[9,10-bis(bromomethyl)-2-anthracenyl]-

Ethanone, 1-[9,10-bis(bromomethyl)-2-anthracenyl]- (CAS No. 790257-33-9): A Versatile Building Block in Modern Chemical Synthesis

Ethanone, 1-[9,10-bis(bromomethyl)-2-anthracenyl]-, identified by its CAS number 790257-33-9, is a sophisticated organic compound that has garnered significant attention in the field of chemical synthesis and pharmaceutical research. This compound, characterized by its unique anthracene core substituted with bromomethyl groups, serves as a pivotal intermediate in the development of various high-value chemical products. The presence of multiple reactive sites on its molecular structure makes it an exceptionally versatile building block for constructing complex molecules.

The molecular structure of Ethanone, 1-[9,10-bis(bromomethyl)-2-anthracenyl]- consists of a central benzene ring fused with two additional benzene rings, forming a tricyclic aromatic system known as anthracene. This core structure is further functionalized by the introduction of two bromomethyl groups at the 9 and 10 positions, which are highly reactive sites capable of undergoing a wide range of chemical transformations. These modifications enhance the compound's utility in synthetic chemistry, allowing for the facile introduction of additional functional groups and the construction of more intricate molecular architectures.

In recent years, there has been a growing interest in the applications of this compound across various sectors, including pharmaceuticals, agrochemicals, and materials science. Its ability to serve as a precursor for the synthesis of complex heterocyclic compounds has made it particularly valuable in drug discovery and development. Researchers have leveraged its reactive bromomethyl groups to introduce nitrogen-containing heterocycles, which are prevalent in many biologically active molecules. This approach has enabled the rapid assembly of novel scaffolds with potential therapeutic properties.

One of the most compelling aspects of Ethanone, 1-[9,10-bis(bromomethyl)-2-anthracenyl]- is its role in facilitating cross-coupling reactions. These reactions are fundamental to modern synthetic organic chemistry and have revolutionized the way complex molecules are constructed. The bromomethyl groups on the anthracene core can undergo palladium-catalyzed cross-coupling reactions with a variety of nucleophiles, including aryl halides and alkynes. This versatility allows chemists to introduce diverse substituents at specific positions within the anthracene framework, enabling the creation of tailored molecular structures with precise stereochemical control.

The pharmaceutical industry has been particularly keen on exploring the potential of this compound due to its structural similarity to natural products and bioactive molecules. For instance, researchers have utilized Ethanone, 1-[9,10-bis(bromomethyl)-2-anthracenyl]- as a starting material for synthesizing analogs of known drugs that exhibit enhanced pharmacological activity or improved metabolic stability. The anthracene moiety is known to be present in several pharmacologically relevant compounds, including those with anticancer and anti-inflammatory properties. By modifying this core structure, scientists can fine-tune the biological activity of their synthetic derivatives.

Moreover, the material science applications of this compound are also noteworthy. Anthracene derivatives are widely used in organic electronics due to their excellent photophysical properties. The bromomethyl functionalization allows for further derivatization into conjugated polymers and small-molecule emitters used in light-emitting diodes (LEDs), organic photovoltaics (OPVs), and other optoelectronic devices. The ability to precisely control the molecular architecture through cross-coupling reactions enables the design of materials with tailored electronic characteristics.

In academic research, Ethanone, 1-[9,10-bis(bromomethyl)-2-anthracenyl]- has been employed as a model compound to study reaction mechanisms and develop new synthetic methodologies. Its well-defined structure and multiple reactive sites make it an ideal candidate for investigating transition-metal catalysis and other advanced synthetic techniques. Recent studies have demonstrated its utility in constructing complex polycyclic aromatic systems through sequential functionalization steps. These investigations not only contribute to the fundamental understanding of organic chemistry but also provide practical tools for future synthetic endeavors.

The synthesis of Ethanone, 1-[9,10-bis(bromomethyl)-2-anthracenyl]- itself is an intricate process that requires careful optimization to achieve high yields and purity. Typically, it involves multi-step reactions starting from commercially available precursors such as anthracene or its derivatives. The introduction of bromomethyl groups often requires specialized conditions to ensure regioselectivity and minimize side reactions. Advances in synthetic chemistry have led to more efficient protocols for this transformation, making it more accessible to researchers worldwide.

The safety profile of this compound is another critical consideration in its application. While it is not classified as a hazardous material under standard regulatory guidelines, proper handling procedures must be followed to ensure safe laboratory practices. Personal protective equipment (PPE) such as gloves and safety goggles should be worn at all times when working with this substance. Additionally, adequate ventilation should be maintained to prevent inhalation exposure.

In conclusion,Ethanone,1-[9,10-bis(bromomethyl)-2-anthracenyl]- (CAS No.790257-33-9) represents a significant advancement in chemical synthesis,offering unparalleled versatility as a building block for pharmaceuticals,agrochemicals,and advanced materials。Its unique structural features and reactivity make it an indispensable tool for chemists seeking to develop novel compounds with tailored properties。As research continues to uncover new applications for this remarkable molecule,its importance in modern chemical science is sure to grow even further。

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