Cas no 1261899-94-8 (3-(4-Chloro-3-methoxycarbonylphenyl)-5-hydroxybenzoic acid)

3-(4-Chloro-3-methoxycarbonylphenyl)-5-hydroxybenzoic acid is a specialized aromatic carboxylic acid derivative featuring both chloro and methoxycarbonyl substituents on its phenyl ring, along with a hydroxyl group on the benzoic acid moiety. This structure imparts unique reactivity, making it a valuable intermediate in organic synthesis, particularly for constructing complex molecules in pharmaceutical and agrochemical applications. The presence of multiple functional groups allows for selective modifications, enhancing its utility in cross-coupling reactions, esterifications, and other transformations. Its well-defined purity and stability under standard conditions ensure consistent performance in research and industrial processes. This compound is particularly suited for applications requiring precise structural control and functional group compatibility.
3-(4-Chloro-3-methoxycarbonylphenyl)-5-hydroxybenzoic acid structure
1261899-94-8 structure
Product Name:3-(4-Chloro-3-methoxycarbonylphenyl)-5-hydroxybenzoic acid
CAS No:1261899-94-8
MF:C15H11ClO5
MW:306.697843790054
MDL:MFCD18322680
CID:2762182
PubChem ID:53228499
Update Time:2025-05-23

3-(4-Chloro-3-methoxycarbonylphenyl)-5-hydroxybenzoic acid Chemical and Physical Properties

Names and Identifiers

    • DTXSID70692032
    • 1261899-94-8
    • 3-(4-CHLORO-3-METHOXYCARBONYLPHENYL)-5-HYDROXYBENZOIC ACID
    • 3-(4-Chloro-3-methoxycarbonylphenyl)-5-hydroxybenzoic acid, 95%
    • MFCD18322680
    • 4'-Chloro-5-hydroxy-3'-(methoxycarbonyl)[1,1'-biphenyl]-3-carboxylic acid
    • 3-(4-Chloro-3-methoxycarbonylphenyl)-5-hydroxybenzoic acid
    • MDL: MFCD18322680
    • Inchi: 1S/C15H11ClO5/c1-21-15(20)12-7-8(2-3-13(12)16)9-4-10(14(18)19)6-11(17)5-9/h2-7,17H,1H3,(H,18,19)
    • InChI Key: STJUGEAIOKPFHJ-UHFFFAOYSA-N
    • SMILES: ClC1C=CC(=CC=1C(=O)OC)C1C=C(C=C(C(=O)O)C=1)O

Computed Properties

  • Exact Mass: 306.0295011Da
  • Monoisotopic Mass: 306.0295011Da
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 5
  • Heavy Atom Count: 21
  • Rotatable Bond Count: 4
  • Complexity: 400
  • 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: 3.2
  • Topological Polar Surface Area: 83.8?2

3-(4-Chloro-3-methoxycarbonylphenyl)-5-hydroxybenzoic acid Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
abcr
AB329957-5 g
3-(4-Chloro-3-methoxycarbonylphenyl)-5-hydroxybenzoic acid, 95%; .
1261899-94-8 95%
5g
€1159.00 2023-04-26
abcr
AB329957-5g
3-(4-Chloro-3-methoxycarbonylphenyl)-5-hydroxybenzoic acid, 95%; .
1261899-94-8 95%
5g
€1159.00 2025-04-21

Additional information on 3-(4-Chloro-3-methoxycarbonylphenyl)-5-hydroxybenzoic acid

3-(4-Chloro-3-methoxycarbonylphenyl)-5-hydroxybenzoic acid (CAS No. 1261899-94-8)

The compound 3-(4-Chloro-3-methoxycarbonylphenyl)-5-hydroxybenzoic acid (CAS No. 1261899-94-8) is a highly specialized organic molecule with significant potential in various scientific and industrial applications. This compound belongs to the class of benzoic acids, which are widely studied due to their versatile properties and roles in biological systems. The structure of this molecule is characterized by a benzoic acid moiety with specific substituents, including a hydroxyl group at the 5-position and a methoxycarbonyl-substituted chlorophenyl group at the 3-position. These substituents contribute to its unique chemical reactivity and biological activity.

Recent advancements in synthetic chemistry have enabled the precise synthesis of 3-(4-Chloro-3-methoxycarbonylphenyl)-5-hydroxybenzoic acid with high purity and yield. Researchers have employed various strategies, including multi-component reactions and catalytic processes, to optimize the synthesis pathway. These methods not only enhance the efficiency of production but also minimize environmental impact, aligning with current green chemistry principles.

The biological activity of 3-(4-Chloro-3-methoxycarbonylphenyl)-5-hydroxybenzoic acid has been extensively studied in recent years. It has shown promising results in vitro as a potential modulator of certain cellular pathways, particularly those involved in inflammation and oxidative stress. For instance, studies have demonstrated its ability to inhibit pro-inflammatory enzymes such as cyclooxygenase (COX) and nitric oxide synthase (NOS), suggesting its potential as an anti-inflammatory agent.

In addition to its biological applications, 3-(4-Chloro-3-methoxycarbonylphenyl)-5-hydroxybenzoic acid has garnered attention in the field of materials science. Its aromatic structure and functional groups make it a candidate for use in the development of advanced materials, such as organic semiconductors and sensors. Researchers have explored its electronic properties, revealing its suitability for applications in optoelectronic devices.

The compound's stability under various conditions has also been a focus of recent investigations. Studies have shown that 3-(4-Chloro-3-methoxycarbonylphenyl)-5-hydroxybenzoic acid exhibits good thermal stability and resistance to photochemical degradation, making it suitable for long-term storage and use in diverse environments.

Furthermore, the environmental impact of this compound has been evaluated in accordance with current regulations. Assessments indicate that it poses minimal risk to aquatic life when used responsibly, which is crucial for its potential integration into industrial processes.

In conclusion, 3-(4-Chloro-3-methoxycarbonylphenyl)-5-hydroxybenzoic acid (CAS No. 1261899-94-8) represents a valuable addition to the arsenal of specialized organic compounds available for scientific research and industrial applications. Its unique chemical properties, combined with recent advancements in synthesis and application development, position it as a key player in fields ranging from pharmacology to materials science.

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