Cas no 57543-59-6 (8-Methoxy-2H-chromene-3-carboxylic acid)

8-Methoxy-2H-chromene-3-carboxylic acid is a chromene derivative featuring a methoxy substituent at the 8-position and a carboxylic acid functional group at the 3-position. This compound serves as a valuable intermediate in organic synthesis, particularly in the development of pharmaceuticals, agrochemicals, and fine chemicals. Its structural framework allows for further functionalization, making it useful in the synthesis of heterocyclic compounds and bioactive molecules. The methoxy group enhances electron density, influencing reactivity in substitution and coupling reactions. With high purity and stability, this compound is suitable for research and industrial applications requiring precise chemical modifications. Its well-defined properties ensure reproducibility in synthetic workflows.
8-Methoxy-2H-chromene-3-carboxylic acid structure
57543-59-6 structure
Product Name:8-Methoxy-2H-chromene-3-carboxylic acid
CAS No:57543-59-6
MF:C11H10O4
MW:206.194703578949
MDL:MFCD00202018
CID:947180
Update Time:2025-10-31

8-Methoxy-2H-chromene-3-carboxylic acid Chemical and Physical Properties

Names and Identifiers

    • 8-Methoxy-2H-chromene-3-carboxylic acid
    • 8-methoxy-2H-chromen-3-carboxylic acid
    • BB_NC-1433
    • MDL: MFCD00202018
    • Inchi: 1S/C11H10O4/c1-14-9-4-2-3-7-5-8(11(12)13)6-15-10(7)9/h2-5H,6H2,1H3,(H,12,13)
    • InChI Key: VAOZSTIKIWWEDB-UHFFFAOYSA-N
    • SMILES: O1CC(C(=O)O)=CC2C=CC=C(C1=2)OC

Computed Properties

  • Exact Mass: 206.05800
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 15
  • Rotatable Bond Count: 2

Experimental Properties

  • Melting Point: 237-240°C
  • PSA: 55.76000
  • LogP: 1.55560

8-Methoxy-2H-chromene-3-carboxylic acid Security Information

  • Hazardous Material Identification: Xi
  • HazardClass:IRRITANT

8-Methoxy-2H-chromene-3-carboxylic acid Customs Data

  • HS CODE:2918990090
  • Customs Data:

    China Customs Code:

    2918990090

    Overview:

    2918990090. Other additional oxy carboxylic acids(Including anhydrides\Acyl halide\Peroxides, peroxyacids and derivatives of this tax number). VAT:17.0%. Tax refund rate:13.0%. Regulatory conditions:nothing. MFN tariff:6.5%. general tariff:30.0%

    Declaration elements:

    Product Name, component content, use to

    Summary:

    2918990090. other carboxylic acids with additional oxygen function and their anhydrides, halides, peroxides and peroxyacids; their halogenated, sulphonated, nitrated or nitrosated derivatives. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:30.0%

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8-Methoxy-2H-chromene-3-carboxylic acid Related Literature

Additional information on 8-Methoxy-2H-chromene-3-carboxylic acid

Exploring the Versatile Applications of 8-Methoxy-2H-chromene-3-carboxylic acid (CAS No. 57543-59-6) in Modern Chemistry

In the realm of organic chemistry, 8-Methoxy-2H-chromene-3-carboxylic acid (CAS No. 57543-59-6) stands out as a compound of significant interest due to its unique structural features and wide-ranging applications. This chromene derivative, characterized by its methoxy group at the 8-position and a carboxylic acid moiety at the 3-position, has garnered attention in pharmaceutical research, material science, and synthetic chemistry. Its molecular framework serves as a building block for more complex structures, making it a valuable asset in drug discovery and development.

The growing interest in natural product analogs and bioactive compounds has propelled research into 8-Methoxy-2H-chromene-3-carboxylic acid. Scientists are particularly intrigued by its potential as a precursor for antioxidant agents and anti-inflammatory compounds, aligning with the current trend toward sustainable therapeutics. Recent studies have explored its role in modulating cellular pathways, which could lead to breakthroughs in managing oxidative stress-related conditions. The compound's chromene core is also being investigated for its fluorescence properties, opening doors for applications in bioimaging and sensor technologies.

From a synthetic perspective, CAS No. 57543-59-6 offers intriguing possibilities for heterocyclic chemistry. Researchers are leveraging its reactive carboxylic acid group to create diverse esters, amides, and other derivatives through green chemistry approaches. This aligns with the pharmaceutical industry's push toward atom-economical synthesis and environmentally friendly processes. The compound's stability under various conditions makes it particularly attractive for high-throughput screening and combinatorial chemistry applications.

The material science community has taken note of 8-Methoxy-2H-chromene-3-carboxylic acid's potential in developing advanced organic materials. Its ability to participate in supramolecular interactions and form coordination complexes with metals is being explored for creating functional polymers and smart materials. These investigations tap into the broader scientific interest in molecular self-assembly and stimuli-responsive systems, areas that are gaining traction in nanotechnology applications.

Analytical chemists have developed sophisticated methods for characterizing 57543-59-6, employing techniques like HPLC-MS, NMR spectroscopy, and X-ray crystallography to study its purity and structural properties. These advancements support quality control in research settings and industrial applications where precise compound specifications are crucial. The availability of high-purity 8-Methoxy-2H-chromene-3-carboxylic acid has facilitated more reproducible studies across multiple disciplines.

Looking toward future applications, researchers are examining how modifications to the chromene scaffold of CAS 57543-59-6 might enhance its biological activity or material properties. Computational chemistry approaches, including molecular docking studies and QSAR modeling, are being employed to predict potential applications and guide synthetic efforts. This intersection of computational prediction and experimental validation represents a cutting-edge approach in modern chemical research.

The commercial availability of 8-Methoxy-2H-chromene-3-carboxylic acid from specialty chemical suppliers has accelerated research efforts worldwide. Current market trends show increasing demand for such fine chemicals as the pharmaceutical and materials sectors expand. Proper handling and storage recommendations, along with detailed safety data sheets, ensure that researchers can work with this compound safely and effectively in various laboratory settings.

In conclusion, 8-Methoxy-2H-chromene-3-carboxylic acid (CAS No. 57543-59-6) represents a multifaceted compound with promising applications across chemistry and related fields. Its continued study contributes to advancements in medicinal chemistry, material science, and synthetic methodology, reflecting the dynamic nature of contemporary chemical research. As scientific understanding of this chromene derivative deepens, new and innovative uses are likely to emerge, further cementing its importance in the chemical sciences.

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