Cas no 82039-85-8 (2-Benzofurancarboxylic acid, 5-hydroxy-3-methyl-, ethyl ester)

2-Benzofurancarboxylic acid, 5-hydroxy-3-methyl-, ethyl ester is a benzofuran derivative with potential applications in organic synthesis and pharmaceutical research. Its structure features a hydroxyl group at the 5-position and a methyl substituent at the 3-position, enhancing its reactivity and selectivity in chemical transformations. The ethyl ester moiety improves solubility in organic solvents, facilitating its use in esterification and coupling reactions. This compound may serve as an intermediate in the synthesis of biologically active molecules, particularly those targeting benzofuran-based scaffolds. Its well-defined molecular framework allows for precise modifications, making it a valuable building block in medicinal chemistry and material science applications.
2-Benzofurancarboxylic acid, 5-hydroxy-3-methyl-, ethyl ester structure
82039-85-8 structure
Product Name:2-Benzofurancarboxylic acid, 5-hydroxy-3-methyl-, ethyl ester
CAS No:82039-85-8
MF:C12H12O4
MW:220.221283912659
CID:699729
PubChem ID:42883413
Update Time:2025-08-05

2-Benzofurancarboxylic acid, 5-hydroxy-3-methyl-, ethyl ester Chemical and Physical Properties

Names and Identifiers

    • 2-Benzofurancarboxylic acid, 5-hydroxy-3-methyl-, ethyl ester
    • ethyl 5-hydroxy-3-methyl-1-benzofuran-2-carboxylate
    • ethyl 5-hydroxy-3-methylbenzofuran-2-carboxylate
    • FT-0710260
    • ethyl 3-methyl-5-hydroxybenzofuran carboxylate
    • SCHEMBL1474090
    • DTXSID70655344
    • 82039-85-8
    • JZGXOINLYSNIPI-UHFFFAOYSA-N
    • Inchi: 1S/C12H12O4/c1-3-15-12(14)11-7(2)9-6-8(13)4-5-10(9)16-11/h4-6,13H,3H2,1-2H3
    • InChI Key: JZGXOINLYSNIPI-UHFFFAOYSA-N
    • SMILES: O1C(C(=O)OCC)=C(C)C2C=C(C=CC1=2)O

Computed Properties

  • Exact Mass: 220.07355886g/mol
  • Monoisotopic Mass: 220.07355886g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 16
  • Rotatable Bond Count: 3
  • Complexity: 266
  • 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: 2.9
  • Topological Polar Surface Area: 59.7?2

2-Benzofurancarboxylic acid, 5-hydroxy-3-methyl-, ethyl ester Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
SHANG HAI HAO HONG Biomedical Technology Co., Ltd.
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SHANG HAI HAO HONG Biomedical Technology Co., Ltd.
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Ethyl 5-hydroxy-3-methylbenzofuran-2-carboxylate
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SHANG HAI HAO HONG Biomedical Technology Co., Ltd.
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Additional information on 2-Benzofurancarboxylic acid, 5-hydroxy-3-methyl-, ethyl ester

2-Benzofurancarboxylic Acid, 5-Hydroxy-3-Methyl-, Ethyl Ester: A Comprehensive Overview

The compound with CAS No. 82039-85-8, commonly referred to as 2-Benzofurancarboxylic acid, 5-hydroxy-3-methyl-, ethyl ester, is a significant molecule in the field of organic chemistry and pharmacology. This compound has garnered attention due to its unique structural properties and potential applications in drug development and material science. Recent studies have highlighted its role in various biological systems, making it a topic of interest for researchers worldwide.

The benzofuran core of this molecule is a key structural feature that contributes to its versatile reactivity and bioactivity. The presence of the hydroxy and methyl substituents at specific positions on the benzofuran ring further enhances its chemical versatility. The ethyl ester group adds to its solubility properties, making it suitable for various synthetic and analytical applications.

Recent advancements in synthetic methodologies have enabled the efficient synthesis of 2-Benzofurancarboxylic acid, 5-hydroxy-3-methyl-, ethyl ester. Researchers have employed strategies such as oxidative coupling and cyclization reactions to construct the benzofuran framework. These methods not only improve yield but also allow for greater control over the stereochemistry of the product, which is crucial for its biological activity.

In terms of applications, this compound has shown promise in the development of novel pharmaceutical agents. Its ability to modulate cellular signaling pathways makes it a potential candidate for treating diseases such as cancer and inflammation. For instance, studies have demonstrated that 2-Benzofurancarboxylic acid, 5-hydroxy-3-methyl-, ethyl ester can inhibit key enzymes involved in tumor progression, suggesting its potential as an anticancer agent.

Moreover, the compound's photophysical properties have been explored for its use in light-sensitive materials. The conjugated system within the benzofuran moiety allows for efficient absorption of light, making it a candidate for applications in optoelectronics and sensors.

Recent research has also focused on the pharmacokinetic profile of 2-Benzofurancarboxylic acid, 5-hydroxy-3-methyl-, ethyl ester, which is essential for its therapeutic potential. Studies indicate that the compound exhibits favorable absorption and distribution characteristics, which are critical for drug delivery.

In conclusion, 2-Benzofurancarboxylic acid, 5-hydroxy-3-methyl-, ethyl ester (CAS No. 82039-85-8) is a multifaceted compound with significant potential in both academic research and industrial applications. Its unique structure, coupled with recent advancements in synthesis and application studies, positions it as a valuable tool in the development of new drugs and materials.

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