Cas no 123206-84-8 (4-(2-bromophenyl)butanal)

4-(2-Bromophenyl)butanal is a brominated aromatic aldehyde compound with the molecular formula C??H??BrO. This intermediate is notable for its reactive aldehyde functional group and bromine-substituted phenyl ring, making it valuable in synthetic organic chemistry for applications such as cross-coupling reactions, nucleophilic additions, and cyclization processes. Its structure allows for selective modifications, facilitating the synthesis of complex molecules in pharmaceuticals, agrochemicals, and materials science. The bromine substituent enhances its utility in palladium-catalyzed transformations, while the butanal chain offers flexibility for further derivatization. The compound is typically handled under controlled conditions due to its sensitivity. High-purity grades ensure consistent performance in research and industrial applications.
4-(2-bromophenyl)butanal structure
4-(2-bromophenyl)butanal structure
Product Name:4-(2-bromophenyl)butanal
CAS No:123206-84-8
MF:C10H11BrO
MW:227.097742319107
CID:1215052
PubChem ID:11746345
Update Time:2025-05-22

4-(2-bromophenyl)butanal Chemical and Physical Properties

Names and Identifiers

    • 4-(2-bromophenyl)butanal
    • AC1Q26EB
    • 4-(2-bromophenyl)-2-butanone
    • AC1L635D
    • CTK1C4161
    • NSC91717
    • AKOS009390800
    • AR-1F5850
    • 4-(2-bromo-phenyl)-but-2-one
    • 4-(o-Bromophenyl)-2-butanone
    • 4-(2-bromophenyl)butyraldehyde
    • 4-(o-Bromphenyl)-butan-2-on
    • SureCN7137459
    • 2-Brom-benzylaceton
    • AC1Q26EB; 4-(2-bromophenyl)-2-butanone; AC1L635D; CTK1C4161; NSC91717; AKOS009390800; AR-1F5850; 4-(2-bromo-phenyl)-but-2-one; 4-(o-Bromophenyl)-2-butanone; 4-(2-bromophenyl)butyraldehyde; 4-(o-Bromphenyl)-butan-2-on; SureCN7137459; 2-Brom-benzylaceton;
    • EN300-1911415
    • 123206-84-8
    • 2-Bromobenzenebutanal
    • Z1233207918
    • AKOS013847051
    • SCHEMBL824824
    • Benzenebutanal, 2-bromo-
    • DTXSID201314715
    • Inchi: 1S/C10H11BrO/c11-10-7-2-1-5-9(10)6-3-4-8-12/h1-2,5,7-8H,3-4,6H2
    • InChI Key: KPTHBSKNZZSKGN-UHFFFAOYSA-N
    • SMILES: BrC1C=CC=CC=1CCCC=O

Computed Properties

  • Exact Mass: 225.99933g/mol
  • Monoisotopic Mass: 225.99933g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 1
  • Heavy Atom Count: 12
  • Rotatable Bond Count: 4
  • Complexity: 136
  • 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: 2.7
  • Topological Polar Surface Area: 17.1?2

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Additional information on 4-(2-bromophenyl)butanal

4-(2-Bromophenyl)Butanal: A Comprehensive Overview

4-(2-Bromophenyl)butanal, also known by its CAS registry number CAS No. 123206-84-8, is a compound of significant interest in both academic and industrial research. This aldehyde derivative has garnered attention due to its unique structural properties and potential applications in various fields, including material science, pharmacology, and organic synthesis.

The molecular structure of 4-(2-bromophenyl)butanal consists of a butanal chain (a four-carbon aldehyde group) attached to a bromophenyl ring at the second position. This configuration imparts the compound with distinct electronic and steric properties, making it a valuable building block in organic chemistry. Recent studies have highlighted its role in the synthesis of bioactive molecules, where its aldehyde group serves as an ideal site for further functionalization.

One of the most notable advancements involving CAS No. 123206-84-8 is its application in the development of novel materials with tailored electronic properties. Researchers have utilized this compound as a precursor in the synthesis of conjugated polymers, which exhibit promising semiconductive behavior. These materials hold potential for applications in flexible electronics and optoelectronic devices, underscoring the importance of 4-(2-bromophenyl)butanal in cutting-edge technology.

In the realm of pharmacology, 4-(2-bromophenyl)butanal has been explored for its potential as an intermediate in drug discovery processes. Its ability to undergo various nucleophilic additions and condensations makes it a versatile starting material for constructing complex molecular frameworks. Recent studies have demonstrated its utility in synthesizing bioactive compounds with anti-inflammatory and anticancer properties, further cementing its role in medicinal chemistry.

The synthesis of CAS No. 123206-84-8 has also been optimized through innovative methodologies. Traditional approaches involving Friedel-Crafts alkylation have been augmented with more efficient catalytic systems, reducing reaction times and enhancing yields. These advancements not only improve the scalability of production but also align with current trends toward sustainable chemical processes.

Beyond its direct applications, 4-(2-bromophenyl)butanal serves as a model compound for studying fundamental organic reactions. Its reactivity patterns provide insights into the behavior of similar aldehyde derivatives under varying conditions, contributing to the broader understanding of organic chemistry principles.

In conclusion, CAS No. 123206-84-8, or 4-(2-bromophenyl)butanal, stands as a pivotal compound in contemporary chemical research. Its versatility across multiple disciplines and recent breakthroughs in its applications underscore its significance as a valuable tool for scientists and engineers alike.

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