Cas no 1375068-95-3 (3-(5-Methoxypyridin-3-yl)benzoic acid)

3-(5-Methoxypyridin-3-yl)benzoic acid is a versatile aromatic carboxylic acid derivative featuring a pyridine core substituted with a methoxy group at the 5-position and a benzoic acid moiety at the 3-position. This compound is valued for its dual functional groups, enabling applications in pharmaceutical intermediates, ligand synthesis, and material science. The methoxy and carboxylic acid groups provide reactive sites for further derivatization, facilitating the development of biologically active molecules or coordination complexes. Its well-defined structure and stability make it suitable for precise synthetic modifications. The compound is typically characterized by high purity and consistent performance in research and industrial settings.
3-(5-Methoxypyridin-3-yl)benzoic acid structure
1375068-95-3 structure
Product Name:3-(5-Methoxypyridin-3-yl)benzoic acid
CAS No:1375068-95-3
MF:C13H11NO3
MW:229.231343507767
CID:1037626
Update Time:2025-10-28

3-(5-Methoxypyridin-3-yl)benzoic acid Chemical and Physical Properties

Names and Identifiers

    • 3-(5-Methoxypyridin-3-yl)benzoic acid
    • ACMC-209cdb
    • AK108132
    • ANW-20301
    • CTK8B0655
    • KB-233298
    • Inchi: 1S/C13H11NO3/c1-17-12-6-11(7-14-8-12)9-3-2-4-10(5-9)13(15)16/h2-8H,1H3,(H,15,16)
    • InChI Key: YPWKEGOCVGNLJE-UHFFFAOYSA-N
    • SMILES: O(C)C1=CN=CC(=C1)C1C=CC=C(C(=O)O)C=1

Computed Properties

  • Exact Mass: 229.07400
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 17
  • Rotatable Bond Count: 3

Experimental Properties

  • PSA: 59.42000
  • LogP: 2.45540

3-(5-Methoxypyridin-3-yl)benzoic acid Customs Data

  • HS CODE:2933399090
  • Customs Data:

    China Customs Code:

    2933399090

    Overview:

    2933399090. Other compounds with non fused pyridine rings in structure. VAT:17.0%. Tax refund rate:13.0%. Regulatory conditions:nothing. MFN tariff:6.5%. general tariff:20.0%

    Declaration elements:

    Product Name, component content, use to, Please indicate the appearance of Urotropine, 6- caprolactam please indicate the appearance, Signing date

    Summary:

    2933399090. other compounds containing an unfused pyridine ring (whether or not hydrogenated) in the structure. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

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Additional information on 3-(5-Methoxypyridin-3-yl)benzoic acid

Introduction to CAS No. 1375068-95-3: 3-(5-Methoxypyridin-3-yl)benzoic Acid

The compound CAS No. 1375068-95-3, commonly referred to as 3-(5-methoxypyridin-3-yl)benzoic acid, 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 discovery and material science. The molecule consists of a benzoic acid moiety attached to a pyridine ring substituted with a methoxy group at the 5-position, creating a structure that exhibits interesting electronic and steric characteristics.

Recent studies have highlighted the importance of pyridine derivatives in various chemical reactions, particularly in the synthesis of bioactive compounds. The presence of the methoxy group at the 5-position of the pyridine ring in 3-(5-methoxypyridin-3-yl)benzoic acid introduces electron-donating effects, which can influence the reactivity and stability of the molecule. This feature makes it a valuable substrate for further functionalization in medicinal chemistry.

In terms of synthesis, researchers have explored various methods to efficiently construct this compound. One notable approach involves the coupling reaction between a substituted pyridine derivative and a benzoic acid moiety under specific catalytic conditions. This method not only ensures high yields but also allows for precise control over the regiochemistry of the product, which is crucial for maintaining its desired properties.

The application of CAS No. 1375068-95-3 extends beyond traditional chemical synthesis. Recent advancements in materials science have demonstrated its potential as a building block for constructing advanced materials, such as coordination polymers and metal-organic frameworks (MOFs). These materials exhibit exceptional properties, including high surface area, tunable porosity, and selective adsorption capabilities, making them ideal for applications in gas storage, catalysis, and sensing technologies.

Moreover, the biological activity of 3-(5-methoxypyridin-3-yl)benzoic acid has been investigated in several preclinical studies. Researchers have found that this compound exhibits moderate inhibitory effects against certain enzymes associated with inflammatory diseases, suggesting its potential as a lead compound for developing anti-inflammatory agents. Further optimization through structural modifications could enhance its bioavailability and efficacy, paving the way for future therapeutic applications.

In conclusion, CAS No. 1375068-95-3, or 3-(5-methoxypyridin-3-yl)benzoic acid, represents a versatile molecule with promising applications across multiple disciplines. Its unique structure, combined with recent research advancements, underscores its importance in contemporary chemical research and development.

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