Cas no 59786-34-4 (4-Formylthiophene-3-carbonitrile)

4-Formylthiophene-3-carbonitrile is a versatile heterocyclic building block used in organic synthesis and pharmaceutical research. Its structure combines a formyl group and a nitrile functionality on a thiophene ring, enabling diverse reactivity for constructing complex molecules. The compound is particularly valuable in the synthesis of thiophene-based derivatives, which are important in materials science and medicinal chemistry. Its high purity and stability make it suitable for precise applications, including the development of agrochemicals, dyes, and bioactive compounds. The presence of both electrophilic and nucleophilic sites allows for selective modifications, facilitating the design of tailored molecular architectures. This compound is handled under standard laboratory conditions, ensuring consistent performance in synthetic workflows.
4-Formylthiophene-3-carbonitrile structure
59786-34-4 structure
Product Name:4-Formylthiophene-3-carbonitrile
CAS No:59786-34-4
MF:C6H3NOS
MW:137.159119844437
MDL:MFCD24387506
CID:4760584
PubChem ID:12280006
Update Time:2025-05-26

4-Formylthiophene-3-carbonitrile Chemical and Physical Properties

Names and Identifiers

    • 4-formylthiophene-3-carbonitrile
    • 3-Thiophenecarbonitrile, 4-formyl-
    • 4-Formylthiophene-3-carbonitrile
    • MDL: MFCD24387506
    • Inchi: 1S/C6H3NOS/c7-1-5-3-9-4-6(5)2-8/h2-4H
    • InChI Key: CASZDPMYYAXNTB-UHFFFAOYSA-N
    • SMILES: S1C=C(C#N)C(C=O)=C1

Computed Properties

  • Exact Mass: 136.99353489g/mol
  • Monoisotopic Mass: 136.99353489g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 9
  • Rotatable Bond Count: 1
  • Complexity: 160
  • 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: 0.8
  • Topological Polar Surface Area: 69.1

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Additional information on 4-Formylthiophene-3-carbonitrile

Exploring the Potential of 4-Formylthiophene-3-Carbonitrile (CAS No 59786-34-4) in Modern Chemistry

The compound 4-formylthiophene-3-carbonitrile, identified by the CAS registry number 59786-34-4, has emerged as a significant molecule in the field of organic synthesis and materials science. This compound, characterized by its unique structure featuring a thiophene ring with a formyl group at position 4 and a cyano group at position 3, has garnered attention due to its versatile reactivity and potential applications in various chemical domains. Recent advancements in synthetic methodologies and its integration into cutting-edge research have further underscored its importance.

The synthesis of 4-formylthiophene-3-carbonitrile typically involves multi-step processes that leverage the reactivity of thiophene derivatives. Researchers have explored various strategies, including oxidative coupling, nucleophilic substitution, and cyclization reactions, to optimize the synthesis pathway. A study published in Chemical Communications highlighted a novel approach utilizing transition metal catalysts to enhance the efficiency and selectivity of the reaction, paving the way for large-scale production.

In terms of applications, 4-formylthiophene-3-carbonitrile has demonstrated potential in several areas. Its electron-withdrawing groups make it an attractive candidate for use in organic electronics. For instance, studies have shown that incorporating this compound into conjugated polymers can significantly improve their electrical conductivity and stability. Additionally, its reactivity towards nucleophilic addition reactions makes it a valuable intermediate in the synthesis of complex molecules, including pharmaceutical agents.

Recent research has also delved into the biological activity of 4-formylthiophene-3-carbonitrile. A team from the University of California reported that this compound exhibits promising anti-inflammatory properties, potentially opening avenues for its use in drug development. Furthermore, its ability to act as a precursor in bioconjugation reactions has been explored, offering new possibilities in medicinal chemistry.

The versatility of 4-formylthiophene-3-carbonitrile extends to its role as a building block in supramolecular chemistry. By exploiting its ability to form hydrogen bonds and π–π interactions, scientists have successfully synthesized self-assembled structures with applications in sensing and catalysis. A groundbreaking study published in Nature Chemistry showcased how this compound can be used to create stimuli-responsive materials, which hold promise for use in smart technologies.

In conclusion, the compound 4-formylthiophene-3-carbonitrile (CAS No 59786-34-4) stands at the forefront of modern chemical research due to its unique properties and diverse applications. As ongoing studies continue to uncover new potentials, this molecule is poised to play an increasingly important role in advancing both academic and industrial chemistry.

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