Cas no 56005-10-8 (2,5-Cyclohexadiene-1,4-dione,2-hydroxy-5-methoxy-3-undecyl-)

2,5-Cyclohexadiene-1,4-dione, 2-hydroxy-5-methoxy-3-undecyl-, is a substituted quinone derivative with potential applications in organic synthesis and materials science. Its structure features a hydroquinone core functionalized with a methoxy group and a long alkyl chain (undecyl), enhancing its solubility in nonpolar solvents and influencing its redox properties. The hydroxy and methoxy substituents contribute to its reactivity in oxidation-reduction processes, making it a candidate for catalytic or electron-transfer applications. The extended alkyl chain may also facilitate self-assembly or integration into hydrophobic matrices. This compound’s unique combination of functional groups offers versatility in designing tailored molecular systems for research or industrial use.
2,5-Cyclohexadiene-1,4-dione,2-hydroxy-5-methoxy-3-undecyl- structure
56005-10-8 structure
Product Name:2,5-Cyclohexadiene-1,4-dione,2-hydroxy-5-methoxy-3-undecyl-
CAS No:56005-10-8
MF:C18H28O4
MW:308.412526130676
CID:372736
PubChem ID:171489
Update Time:2025-11-02

2,5-Cyclohexadiene-1,4-dione,2-hydroxy-5-methoxy-3-undecyl- Chemical and Physical Properties

Names and Identifiers

    • 2,5-Cyclohexadiene-1,4-dione,2-hydroxy-5-methoxy-3-undecyl-
    • 2-hydroxy-5-methoxy-3-undecylcyclohexa-2,5-diene-1,4-dione
    • 5-O-methylembelin
    • 2-Hydroxy-5-methoxy-3-undecyl-[1,4]benzoquinone
    • 2-Hydroxy-5-methoxy-3-undecyl-1,4-benzoquinone
    • AC1L57LN
    • C10373
    • CHEBI:65842
    • CHEMBL471270
    • CTK6D9002
    • ALPHA-ACETAMIDO-2-METHYLCINNAMICACID
    • 5-O-methyl embelin
    • 2,5-Cyclohexadiene-1,4-dione, 2-hydroxy-5-methoxy-3-undecyl-
    • BDBM50078845
    • UNII-4H3R9623BA
    • 56005-10-8
    • 4H3R9623BA
    • HY-W510159
    • CS-0595743
    • DTXSID10204577
    • 2-hydroxy-5-methoxy-3-undecyl[1,4]benzoquinone
    • Q27134335
    • 5-METHOXY-2-OXIDANYL-3-UNDECYL-CYCLOHEXA-2,5-DIENE-1,4-DIONE
    • G83514
    • DA-69791
    • MDL: MFCD07782226
    • Inchi: 1S/C18H28O4/c1-3-4-5-6-7-8-9-10-11-12-14-17(20)15(19)13-16(22-2)18(14)21/h13,20H,3-12H2,1-2H3
    • InChI Key: KHBJLRRAMCJZLZ-UHFFFAOYSA-N
    • SMILES: OC1C(C=C(C(C=1CCCCCCCCCCC)=O)OC)=O

Computed Properties

  • Exact Mass: 308.19884
  • Monoisotopic Mass: 308.19875937g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 22
  • Rotatable Bond Count: 11
  • Complexity: 446
  • 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: 5.7
  • Topological Polar Surface Area: 63.6?2

Experimental Properties

  • PSA: 63.6

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2,5-Cyclohexadiene-1,4-dione,2-hydroxy-5-methoxy-3-undecyl- Suppliers

Amadis Chemical Company Limited
Gold Member
Audited Supplier Audited Supplier
(CAS:56005-10-8)2,5-Cyclohexadiene-1,4-dione,2-hydroxy-5-methoxy-3-undecyl-
Order Number:A1242464
Stock Status:in Stock
Quantity:1g
Purity:99%
Pricing Information Last Updated:Friday, 30 August 2024 19:14
Price ($):1962

Additional information on 2,5-Cyclohexadiene-1,4-dione,2-hydroxy-5-methoxy-3-undecyl-

Comprehensive Overview of 2,5-Cyclohexadiene-1,4-dione,2-hydroxy-5-methoxy-3-undecyl- (CAS No. 56005-10-8)

2,5-Cyclohexadiene-1,4-dione,2-hydroxy-5-methoxy-3-undecyl-, with the CAS number 56005-10-8, is a specialized organic compound that has garnered significant attention in both academic and industrial research. This compound belongs to the class of quinone derivatives, which are known for their diverse applications in pharmaceuticals, materials science, and organic synthesis. The unique structural features of this molecule, including the hydroxy and methoxy substituents, as well as the undecyl side chain, contribute to its distinct chemical properties and reactivity.

The compound's molecular structure is characterized by a 2,5-cyclohexadiene-1,4-dione core, which is a common motif in many biologically active molecules. The presence of the hydroxy group at the 2-position and the methoxy group at the 5-position introduces polarity and hydrogen-bonding capabilities, making it a versatile intermediate in synthetic chemistry. The undecyl chain at the 3-position adds lipophilicity, which can influence the compound's solubility and interaction with biological membranes.

One of the most intriguing aspects of 2,5-Cyclohexadiene-1,4-dione,2-hydroxy-5-methoxy-3-undecyl- is its potential role in antioxidant and anti-inflammatory applications. Recent studies have highlighted the significance of quinone derivatives in modulating oxidative stress pathways, which are implicated in various chronic diseases. Researchers are particularly interested in how the hydroxy-methoxy substitution pattern might enhance the compound's ability to scavenge free radicals or interact with cellular redox systems.

In the field of organic electronics, 56005-10-8 has shown promise as a building block for conjugated polymers and small-molecule semiconductors. The quinone core can participate in electron-transfer processes, while the undecyl side chain improves solubility in organic solvents, facilitating solution-based processing techniques. This makes the compound a candidate for applications in organic photovoltaics, light-emitting diodes (OLEDs), and sensors.

The synthesis of 2,5-Cyclohexadiene-1,4-dione,2-hydroxy-5-methoxy-3-undecyl- typically involves multi-step organic reactions, including Friedel-Crafts alkylation, oxidation, and functional group interconversion. Researchers have explored various routes to optimize yield and purity, with recent advancements focusing on green chemistry principles to reduce environmental impact. The compound's CAS number 56005-10-8 is frequently referenced in patent literature, indicating its commercial relevance.

From a market perspective, the demand for specialized quinone derivatives like 56005-10-8 is driven by their applications in pharmaceutical intermediates, agrochemicals, and advanced materials. Companies involved in fine chemicals and custom synthesis often list this compound in their portfolios, catering to research institutions and industrial clients. The global market for such compounds is expected to grow, particularly in regions with strong biotech and nanotechnology sectors.

For researchers working with 2,5-Cyclohexadiene-1,4-dione,2-hydroxy-5-methoxy-3-undecyl-, proper handling and storage are essential to maintain stability. The compound should be stored in a cool, dry environment, protected from light and moisture, to prevent degradation. Analytical techniques such as HPLC, NMR, and mass spectrometry are commonly employed to characterize its purity and confirm structural integrity.

In conclusion, 2,5-Cyclohexadiene-1,4-dione,2-hydroxy-5-methoxy-3-undecyl- (CAS 56005-10-8) represents a fascinating example of how subtle modifications to a quinone scaffold can yield compounds with diverse and valuable properties. Its applications span from biomedical research to cutting-edge materials science, making it a subject of ongoing investigation. As synthetic methodologies advance and new applications emerge, this compound is likely to remain a key player in the realm of specialty chemicals.

Recommended suppliers
Amadis Chemical Company Limited
(CAS:56005-10-8)2,5-Cyclohexadiene-1,4-dione,2-hydroxy-5-methoxy-3-undecyl-
A1242464
Purity:99%
Quantity:1g
Price ($):1962
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