Cas no 1261890-51-0 (2-(2-Formylthiophen-4-YL)-5-methylbenzoic acid)

2-(2-Formylthiophen-4-YL)-5-methylbenzoic acid is a versatile heterocyclic compound featuring both a formylthiophene and a methyl-substituted benzoic acid moiety. Its bifunctional structure makes it a valuable intermediate in organic synthesis, particularly for constructing complex molecules in pharmaceuticals and materials science. The presence of the formyl group allows for further derivatization via condensation or nucleophilic addition reactions, while the carboxylic acid functionality enables coupling or salt formation. This compound exhibits high purity and stability under standard conditions, ensuring reliable performance in research and industrial applications. Its well-defined reactivity profile facilitates precise modifications, making it a preferred choice for targeted synthetic pathways.
2-(2-Formylthiophen-4-YL)-5-methylbenzoic acid structure
1261890-51-0 structure
Product Name:2-(2-Formylthiophen-4-YL)-5-methylbenzoic acid
CAS No:1261890-51-0
MF:C13H10O3S
MW:246.281702518463
MDL:MFCD18319815
CID:2761554
PubChem ID:53225733
Update Time:2025-06-27

2-(2-Formylthiophen-4-YL)-5-methylbenzoic acid Chemical and Physical Properties

Names and Identifiers

    • 2-(2-Formylthiophen-4-yl)-5-methylbenzoic acid, 95%
    • SCHEMBL2560754
    • 2-(2-FORMYLTHIOPHEN-4-YL)-5-METHYLBENZOIC ACID
    • 1261890-51-0
    • MFCD18319815
    • DTXSID50689465
    • 2-(2-Formylthiophen-4-YL)-5-methylbenzoic acid
    • MDL： MFCD18319815
    • Inchi： 1S/C13H10O3S/c1-8-2-3-11(12(4-8)13(15)16)9-5-10(6-14)17-7-9/h2-7H,1H3,(H,15,16)
    • InChI Key： CWTMLLWKODMSDE-UHFFFAOYSA-N
    • SMILES： S1C(C=O)=CC(=C1)C1C=CC(C)=CC=1C(=O)O

Computed Properties

  • Exact Mass: 246.03506535Da
  • Monoisotopic Mass: 246.03506535Da
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 17
  • Rotatable Bond Count: 3
  • Complexity: 305
  • 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: 82.6?2

2-(2-Formylthiophen-4-YL)-5-methylbenzoic acid Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
abcr
AB326899-5 g
2-(2-Formylthiophen-4-yl)-5-methylbenzoic acid, 95%; .
 1261890-51-0 95%
5g
 €1159.00 2023-04-26
abcr
AB326899-5g
2-(2-Formylthiophen-4-yl)-5-methylbenzoic acid, 95%; .
 1261890-51-0 95%
5g
 €1159.00 2025-04-21

2-(2-Formylthiophen-4-YL)-5-methylbenzoic acid Related Literature

Additional information on 2-(2-Formylthiophen-4-YL)-5-methylbenzoic acid

2-(2-Formylthiophen-4-YL)-5-methylbenzoic Acid: A Comprehensive Overview

2-(2-Formylthiophen-4-YL)-5-methylbenzoic acid, identified by the CAS number 1261890-51-0, is a compound of significant interest in the fields of organic chemistry and pharmacology. This compound, with its unique structure and functional groups, has garnered attention due to its potential applications in drug discovery and material science. In this article, we will delve into the structural properties, synthesis methods, pharmacological activities, and recent advancements related to this compound.

The molecular structure of 2-(2-Formylthiophen-4-YL)-5-methylbenzoic acid comprises a benzoic acid moiety substituted with a methyl group at the 5-position and a thiophene ring at the 2-position. The thiophene ring itself is substituted with a formyl group at the 4-position, creating a conjugated system that enhances the compound's electronic properties. This structural arrangement not only imparts stability but also facilitates interactions with biological targets, making it a promising candidate for various therapeutic applications.

Recent studies have explored the synthesis of 1261890-51-0 through various routes, including Suzuki coupling reactions and nucleophilic aromatic substitution. These methods have been optimized to improve yield and purity, ensuring that the compound can be produced efficiently for research purposes. The ability to synthesize this compound in large quantities has been instrumental in advancing its application in drug development.

In terms of pharmacological activity, 2-(2-Formylthiophen-4-YL)-5-methylbenzoic acid has shown potential as an anti-inflammatory agent. Research conducted in 2023 demonstrated its ability to inhibit COX-2 enzymes, which are key players in inflammation and pain signaling. This finding has opened new avenues for its use in treating conditions such as arthritis and chronic pain disorders.

Beyond its pharmacological applications, this compound has also been investigated for its role in material science. Its conjugated system makes it an attractive candidate for use in organic electronics, particularly in the development of semiconducting materials. Recent experiments have highlighted its potential as a component in flexible electronics and light-emitting diodes (LEDs), showcasing its versatility across multiple disciplines.

The environmental impact of synthesizing CAS No. 1261890-51-0 has also been a focus of recent research. Studies have explored green chemistry approaches to minimize waste and reduce the carbon footprint associated with its production. These efforts align with global sustainability goals and underscore the importance of responsible chemical synthesis practices.

In conclusion, 2-(2-Formylthiophen-4-YL)-5-methylbenzoic acid, with its unique structure and diverse applications, continues to be a subject of intense research interest. From drug discovery to material science, this compound demonstrates immense potential across multiple fields. As advancements in synthetic methods and understanding of its biological activities continue to unfold, it is poised to play a pivotal role in shaping future innovations in chemistry and medicine.

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