Cas no 100885-87-8 (4-(naphthalen-2-yl)butanal)

4-(Naphthalen-2-yl)butanal is a versatile organic compound featuring a naphthalene moiety linked to a butanal chain. This structure makes it a valuable intermediate in organic synthesis, particularly for the preparation of pharmaceuticals, agrochemicals, and specialty chemicals. The aromatic naphthalene group enhances stability and reactivity, while the aldehyde functionality allows for further derivatization, such as condensation or reduction reactions. Its well-defined molecular architecture ensures consistent performance in synthetic applications. The compound is typically supplied in high purity, ensuring reliable results in research and industrial processes. Proper handling under inert conditions is recommended due to the reactivity of the aldehyde group.
4-(naphthalen-2-yl)butanal structure
4-(naphthalen-2-yl)butanal structure
Product Name:4-(naphthalen-2-yl)butanal
CAS No:100885-87-8
MF:C14H14O
MW:198.260364055634
CID:1127315
PubChem ID:14606593
Update Time:2025-11-02

4-(naphthalen-2-yl)butanal Chemical and Physical Properties

Names and Identifiers

    • 2-Naphthalenebutanal
    • 4-naphthalen-2-ylbutanal
    • 4-(naphthalen-2-yl)butanal
    • DTXSID30562121
    • 100885-87-8
    • EN300-1848201
    • SCHEMBL7676690
    • Inchi: 1S/C14H14O/c15-10-4-3-5-12-8-9-13-6-1-2-7-14(13)11-12/h1-2,6-11H,3-5H2
    • InChI Key: WFTLTSOFIDZVLY-UHFFFAOYSA-N
    • SMILES: O=CCCCC1C=CC2C=CC=CC=2C=1

Computed Properties

  • Exact Mass: 198.10452
  • Monoisotopic Mass: 198.104465066g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 1
  • Heavy Atom Count: 15
  • Rotatable Bond Count: 4
  • Complexity: 200
  • 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

4-(naphthalen-2-yl)butanal Pricemore >>

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Additional information on 4-(naphthalen-2-yl)butanal

4-(Naphthalen-2-yl)butanal (CAS No. 100885-87-8): A Versatile Aromatic Aldehyde for Advanced Applications

4-(Naphthalen-2-yl)butanal (CAS 100885-87-8) is a specialized aromatic aldehyde compound that has gained significant attention in pharmaceutical and material science research. This naphthalene derivative features a unique molecular structure combining a naphthalene ring system with a butanal side chain, making it valuable for various synthetic applications.

The compound's chemical properties include a molecular weight of 198.26 g/mol and the characteristic reactivity of both aromatic systems and aldehyde functional groups. Researchers particularly value 4-(naphthalen-2-yl)butanal for its role as a building block in organic synthesis, where it serves as a precursor for more complex molecular architectures.

In pharmaceutical research, this compound has shown promise in the development of novel drug candidates. The naphthalene moiety provides excellent π-stacking interactions, while the aldehyde group offers versatile synthetic handles for further derivatization. Recent studies have explored its potential in creating small molecule therapeutics targeting various biological pathways.

The material science applications of 4-(naphthalen-2-yl)butanal are equally impressive. Its aromatic character contributes to the development of organic electronic materials, particularly in the design of molecular semiconductors and photovoltaic components. The compound's ability to participate in cross-coupling reactions makes it valuable for constructing conjugated polymer systems.

Current market trends show growing demand for specialty aromatic aldehydes like 4-(naphthalen-2-yl)butanal. The global push toward sustainable chemistry and green synthesis methods has increased interest in efficient production processes for such high-value intermediates. Manufacturers are responding with improved synthetic protocols that minimize waste and energy consumption.

From a safety perspective, proper handling of 4-(naphthalen-2-yl)butanal requires standard laboratory precautions for organic compounds. While not classified as highly hazardous, appropriate personal protective equipment should be used when working with this material. Storage recommendations typically include protection from light and moisture in a cool, well-ventilated area.

The analytical characterization of 4-(naphthalen-2-yl)butanal typically involves techniques such as NMR spectroscopy, mass spectrometry, and HPLC analysis. These methods ensure the chemical purity and structural integrity of the compound, which is crucial for research applications where precise molecular composition is required.

Looking ahead, the future of 4-(naphthalen-2-yl)butanal appears bright as researchers continue to discover new applications. Emerging fields like molecular nanotechnology and supramolecular chemistry may find innovative uses for this versatile organic building block. Its combination of aromatic stability and functional group reactivity makes it particularly attractive for cutting-edge scientific developments.

For researchers seeking high-quality 4-(naphthalen-2-yl)butanal, it's essential to source the compound from reputable suppliers who can provide comprehensive analytical data and certificates of analysis. The growing importance of structure-activity relationships in drug discovery and structure-property relationships in materials science makes reliable compound sourcing increasingly critical.

In conclusion, 4-(naphthalen-2-yl)butanal (CAS 100885-87-8) represents an important chemical intermediate with diverse applications across multiple scientific disciplines. Its unique molecular architecture and chemical functionality continue to inspire innovative research in both pharmaceutical development and advanced materials, positioning it as a valuable tool for modern chemical science.

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