Cas no 131988-25-5 (3-(4-Chloro-1,2,5-thiadiazol-3-yl)-1-methylpyridinium iodide)

3-(4-Chloro-1,2,5-thiadiazol-3-yl)-1-methylpyridinium iodide is a heterocyclic organic compound featuring a thiadiazole core fused with a pyridinium moiety. This structure imparts unique reactivity, making it valuable in synthetic chemistry, particularly as an intermediate for pharmaceuticals and agrochemicals. The chloro-substituted thiadiazole enhances electrophilic character, facilitating nucleophilic substitution reactions, while the pyridinium iodide component improves solubility in polar solvents. Its stability under standard conditions ensures reliable handling and storage. Applications include the development of bioactive molecules, where its modular design allows for further functionalization. The compound’s distinct electronic properties also make it suitable for materials science research, such as in optoelectronic or coordination chemistry studies.
3-(4-Chloro-1,2,5-thiadiazol-3-yl)-1-methylpyridinium iodide structure
131988-25-5 structure
Product Name:3-(4-Chloro-1,2,5-thiadiazol-3-yl)-1-methylpyridinium iodide
CAS No:131988-25-5
MF:C8H7ClIN3S
MW:339.583750963211
CID:4694380
Update Time:2025-06-13

3-(4-Chloro-1,2,5-thiadiazol-3-yl)-1-methylpyridinium iodide Chemical and Physical Properties

Names and Identifiers

    • 3-(4-chloro-1,2,5-thiadiazol-3-yl)-1-methylpyridinium iodide
    • SKDWFKQVJIGJCO-UHFFFAOYSA-M
    • 3-(3-Chloro-1,2,5-thiadiazol-4-yl)-1-methylpyridinium iodide
    • 3-(4-Chloro-1,2,5-thiadiazol-3-yl)-1-methylpyridinium iodide
    • Inchi: 1S/C8H7ClN3S.HI/c1-12-4-2-3-6(5-12)7-8(9)11-13-10-7;/h2-5H,1H3;1H/q+1;/p-1
    • InChI Key: SKDWFKQVJIGJCO-UHFFFAOYSA-M
    • SMILES: [I-].ClC1C(C2=CC=C[N+](C)=C2)=NSN=1

Computed Properties

  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 14
  • Rotatable Bond Count: 1
  • Complexity: 181
  • Topological Polar Surface Area: 57.9

3-(4-Chloro-1,2,5-thiadiazol-3-yl)-1-methylpyridinium iodide Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
SHANG HAI HAO HONG Biomedical Technology Co., Ltd.
1620013-1g
3-(4-Chloro-1,2,5-thiadiazol-3-yl)-1-methylpyridin-1-ium iodide
131988-25-5 98%
1g
¥5502.00 2024-08-09

Additional information on 3-(4-Chloro-1,2,5-thiadiazol-3-yl)-1-methylpyridinium iodide

Comprehensive Overview of 3-(4-Chloro-1,2,5-thiadiazol-3-yl)-1-methylpyridinium iodide (CAS No. 131988-25-5)

The compound 3-(4-Chloro-1,2,5-thiadiazol-3-yl)-1-methylpyridinium iodide (CAS No. 131988-25-5) is a specialized organic salt with significant applications in pharmaceutical research and material science. Its unique molecular structure, featuring a thiadiazole ring and a pyridinium moiety, makes it a valuable intermediate in the synthesis of bioactive molecules. Researchers and industry professionals frequently search for this compound due to its potential in drug discovery, particularly in the development of novel heterocyclic compounds and ionic liquids.

In recent years, the demand for 3-(4-Chloro-1,2,5-thiadiazol-3-yl)-1-methylpyridinium iodide has surged, driven by advancements in medicinal chemistry and green chemistry. The compound's CAS No. 131988-25-5 is often queried in scientific databases, reflecting its relevance in cutting-edge research. Its applications extend to catalysis, where it serves as a precursor for N-heterocyclic carbenes, and in electrochemical studies, owing to its ionic nature. This versatility aligns with the growing interest in sustainable synthetic methods and high-performance materials.

The synthesis of 3-(4-Chloro-1,2,5-thiadiazol-3-yl)-1-methylpyridinium iodide involves the quaternization of a pyridine derivative with a 4-chloro-1,2,5-thiadiazole precursor, followed by iodide salt formation. This process highlights the compound's role in structure-activity relationship (SAR) studies, a hot topic in drug design. Researchers often explore its physicochemical properties, such as solubility and stability, to optimize its use in bioconjugation and molecular imaging.

From an industrial perspective, CAS No. 131988-25-5 is gaining traction due to its compatibility with flow chemistry and continuous manufacturing—key trends in modern process optimization. Its iodide counterion enhances its utility in photocatalysis, a field rapidly expanding with the rise of renewable energy technologies. These attributes make it a frequent subject in patent literature and academic publications.

Safety and handling of 3-(4-Chloro-1,2,5-thiadiazol-3-yl)-1-methylpyridinium iodide are critical considerations, though it is not classified as hazardous under standard regulations. Its storage conditions and compatibility with other reagents are commonly searched topics, reflecting practical concerns in laboratory settings. The compound's spectroscopic data (e.g., NMR, IR) is also widely referenced for quality control purposes.

In summary, 3-(4-Chloro-1,2,5-thiadiazol-3-yl)-1-methylpyridinium iodide (CAS No. 131988-25-5) exemplifies the intersection of chemical innovation and applied research. Its multifaceted applications—from pharmaceutical intermediates to advanced materials—underscore its importance in contemporary science. As interest in tailored heterocycles and ionic compounds grows, this compound will likely remain a focal point in scientific and industrial discourse.

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