Cas no 138490-96-7 (3,4-Dimethoxy-2-(trifluoromethyl)benzaldehyde)

3,4-Dimethoxy-2-(trifluoromethyl)benzaldehyde is a fluorinated aromatic aldehyde characterized by its distinct trifluoromethyl and dimethoxy substituents. This compound serves as a versatile intermediate in organic synthesis, particularly in the preparation of pharmaceuticals, agrochemicals, and specialty materials. The electron-withdrawing trifluoromethyl group enhances reactivity, while the dimethoxy substituents contribute to stability and solubility in organic solvents. Its well-defined structure makes it valuable for constructing complex molecules, including bioactive compounds. The compound is typically handled under standard laboratory conditions, with purity levels tailored for synthetic applications. Its consistent performance and functional group compatibility make it a reliable choice for researchers in medicinal and materials chemistry.
3,4-Dimethoxy-2-(trifluoromethyl)benzaldehyde structure
138490-96-7 structure
Product Name:3,4-Dimethoxy-2-(trifluoromethyl)benzaldehyde
CAS No:138490-96-7
MF:C10H9F3O3
MW:234.171873807907
MDL:MFCD14705135
CID:1026948
PubChem ID:11241788
Update Time:2025-06-13

3,4-Dimethoxy-2-(trifluoromethyl)benzaldehyde Chemical and Physical Properties

Names and Identifiers

    • 3,4-Dimethoxy-2-(trifluoromethyl)benzaldehyde
    • 3,4-dimethoxy-2-trifluoromethylbenzaldehyde
    • AGN-PC-0053GQ
    • AK-48700
    • ANW-59103
    • Benzaldehyde, 3,4-dimethoxy-2-(trifluoromethyl)-
    • CTK8B7999
    • KB-17082
    • SB85352
    • MFCD14705135
    • AKOS016002210
    • 138490-96-7
    • RVBGIIWJLAXZGT-UHFFFAOYSA-N
    • DB-085276
    • SCHEMBL6149994
    • CS-0328812
    • DS-14819
    • DTXSID30459845
    • MDL: MFCD14705135
    • Inchi: 1S/C10H9F3O3/c1-15-7-4-3-6(5-14)8(9(7)16-2)10(11,12)13/h3-5H,1-2H3
    • InChI Key: RVBGIIWJLAXZGT-UHFFFAOYSA-N
    • SMILES: FC(C1C(C=O)=CC=C(C=1OC)OC)(F)F

Computed Properties

  • Exact Mass: 234.05037863g/mol
  • Monoisotopic Mass: 234.05037863g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 16
  • Rotatable Bond Count: 4
  • Complexity: 242
  • 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: 2.2
  • Topological Polar Surface Area: 35.5?2

3,4-Dimethoxy-2-(trifluoromethyl)benzaldehyde Pricemore >>

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Additional information on 3,4-Dimethoxy-2-(trifluoromethyl)benzaldehyde

Exploring the Properties and Applications of 3,4-Dimethoxy-2-(trifluoromethyl)benzaldehyde (CAS No. 138490-96-7)

In the realm of organic chemistry, 3,4-Dimethoxy-2-(trifluoromethyl)benzaldehyde (CAS No. 138490-96-7) stands out as a versatile and highly functionalized aromatic aldehyde. This compound, characterized by its dimethoxy and trifluoromethyl substituents, has garnered significant attention in pharmaceutical and agrochemical research. Its unique structural features make it a valuable intermediate in the synthesis of complex molecules, particularly those targeting drug discovery and crop protection applications.

The 3,4-Dimethoxy-2-(trifluoromethyl)benzaldehyde molecule combines electron-donating methoxy groups with an electron-withdrawing trifluoromethyl group, creating a distinct electronic profile. This balance of substituents influences its reactivity, making it a sought-after building block for heterocyclic chemistry and medicinal chemistry projects. Researchers frequently explore its potential in creating novel bioactive compounds, especially in the development of central nervous system (CNS) agents and anti-inflammatory drugs.

Recent trends in green chemistry have sparked interest in optimizing the synthesis of 3,4-Dimethoxy-2-(trifluoromethyl)benzaldehyde. Many laboratories now focus on developing catalyst-free or solvent-free routes to produce this compound, addressing growing concerns about environmental sustainability in chemical manufacturing. These advancements align with the pharmaceutical industry's push toward greener synthetic methodologies while maintaining high yields and purity standards.

The compound's fluorinated aromatic structure contributes to its growing importance in PET radiopharmaceuticals development. With increasing demand for diagnostic imaging agents, researchers are investigating how the trifluoromethyl group in 3,4-Dimethoxy-2-(trifluoromethyl)benzaldehyde can be leveraged to create novel molecular probes for neurological disorders. This application has become particularly relevant given the rising global prevalence of neurodegenerative diseases.

In material science, the unique electronic properties of 3,4-Dimethoxy-2-(trifluoromethyl)benzaldehyde have shown promise for developing organic electronic materials. Its ability to influence charge transport characteristics makes it interesting for OLED technology and organic semiconductors. As the electronics industry seeks more sustainable alternatives to conventional materials, this compound's potential in flexible electronics continues to be explored.

Quality control remains paramount when working with 3,4-Dimethoxy-2-(trifluoromethyl)benzaldehyde. Analytical techniques such as HPLC, GC-MS, and NMR spectroscopy are essential for verifying the compound's purity and structure. The pharmaceutical industry particularly emphasizes ICH guidelines for impurities control, making thorough characterization critical for regulatory compliance in API synthesis.

Storage and handling of 3,4-Dimethoxy-2-(trifluoromethyl)benzaldehyde require attention to its aldehyde functionality, which can be sensitive to oxidation. Best practices recommend storage under inert atmosphere at controlled temperatures to maintain stability. These considerations are especially important for researchers working on long-term stability studies of drug candidates incorporating this structural motif.

The future outlook for 3,4-Dimethoxy-2-(trifluoromethyl)benzaldehyde appears promising as new applications continue to emerge. With growing interest in personalized medicine and targeted therapies, this compound's role as a versatile intermediate will likely expand. Ongoing research into its structure-activity relationships may unlock additional therapeutic possibilities, particularly in areas like oncology and infectious diseases where fluorinated compounds have demonstrated significant potential.

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