Cas no 19968-59-3 (Thiazole, 2,5-dimethyl-4-phenyl-)

2,5-Dimethyl-4-phenylthiazole is a heterocyclic organic compound featuring a thiazole core substituted with methyl groups at the 2- and 5-positions and a phenyl group at the 4-position. This structure imparts unique electronic and steric properties, making it valuable in pharmaceutical and agrochemical research. The compound serves as a versatile intermediate in synthesizing bioactive molecules, particularly those targeting antimicrobial or anti-inflammatory applications. Its aromatic and heterocyclic framework enhances stability and reactivity, facilitating further functionalization. The presence of both electron-donating (methyl) and electron-withdrawing (phenyl) groups allows fine-tuning of its physicochemical characteristics, supporting its use in advanced material science and medicinal chemistry. High purity grades ensure reproducibility in research and industrial applications.
Thiazole, 2,5-dimethyl-4-phenyl- structure
19968-59-3 structure
Product Name:Thiazole, 2,5-dimethyl-4-phenyl-
CAS No:19968-59-3
MF:C11H11NS
MW:189.276741266251
CID:1393444
PubChem ID:5028406
Update Time:2025-11-02

Thiazole, 2,5-dimethyl-4-phenyl- Chemical and Physical Properties

Names and Identifiers

    • Thiazole, 2,5-dimethyl-4-phenyl-
    • 2,5-Dimethyl-4-phenylthiazole
    • 2,5-dimethyl-4-phenyl-1,3-thiazole
    • CS-0210290
    • SCHEMBL2093741
    • BS-32042
    • EU-0039978
    • MFCD01021040
    • 19968-59-3
    • MDL: MFCD01021040
    • Inchi: 1S/C11H11NS/c1-8-11(12-9(2)13-8)10-6-4-3-5-7-10/h3-7H,1-2H3
    • InChI Key: MSTZWWAYEIGOJI-UHFFFAOYSA-N
    • SMILES: S1C(C)=NC(=C1C)C1C=CC=CC=1

Computed Properties

  • Exact Mass: 189.06133
  • Monoisotopic Mass: 189.06122053g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 1
  • Heavy Atom Count: 13
  • Rotatable Bond Count: 1
  • Complexity: 166
  • 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: 3.4
  • Topological Polar Surface Area: 41.1?2

Experimental Properties

  • PSA: 12.89

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Additional information on Thiazole, 2,5-dimethyl-4-phenyl-

Thiazole, 2,5-dimethyl-4-phenyl- (CAS No. 19968-59-3): Properties, Applications, and Market Insights

Thiazole, 2,5-dimethyl-4-phenyl- (CAS No. 19968-59-3) is a specialized organic compound belonging to the thiazole derivatives family. This heterocyclic compound features a five-membered ring containing both sulfur and nitrogen atoms, making it a valuable building block in various chemical syntheses. With the growing interest in heterocyclic chemistry and fine chemicals, this compound has gained attention for its unique structural features and versatile applications.

The molecular structure of 2,5-dimethyl-4-phenylthiazole combines aromatic properties with the reactivity of the thiazole ring. Researchers have explored its potential in pharmaceutical intermediates, material science, and flavor and fragrance applications. Recent studies in green chemistry have also investigated eco-friendly synthesis methods for such thiazole derivatives, aligning with current industry trends toward sustainable production.

In the pharmaceutical sector, thiazole derivatives like 2,5-dimethyl-4-phenylthiazole are increasingly important due to their biological activity. While this specific compound isn't a drug itself, it serves as a precursor in developing compounds with potential antimicrobial properties or central nervous system activity, topics frequently searched in academic and industrial research databases.

The material science applications of CAS 19968-59-3 are particularly interesting for researchers working on organic electronics and photovoltaic materials. Its conjugated system and electron-rich nature make it a candidate for studying charge transport properties in organic semiconductors, a hot topic in renewable energy research.

From a commercial perspective, the market for specialty thiazole compounds has shown steady growth, driven by demand from the pharmaceutical and agrochemical industries. Quality specifications for 2,5-dimethyl-4-phenylthiazole typically include purity levels above 98%, with strict control of residual solvents and byproducts, reflecting the compound's use in high-value applications.

Analytical characterization of Thiazole, 2,5-dimethyl-4-phenyl- typically involves techniques like HPLC, GC-MS, and NMR spectroscopy. These methods verify the compound's identity and purity, essential for research and industrial applications where consistency is critical. Recent advancements in analytical chemistry have improved detection limits for impurities in such specialty chemicals.

Storage and handling recommendations for CAS 19968-59-3 follow standard practices for organic compounds. It should be kept in tightly sealed containers under inert atmosphere when long-term storage is required, protected from moisture and extreme temperatures to maintain stability. These precautions ensure the material retains its quality for research or production use.

The synthesis of 2,5-dimethyl-4-phenylthiazole typically involves condensation reactions starting from appropriate carbonyl compounds and thioamides. Recent patent literature reveals ongoing optimization of synthetic routes to improve yields and reduce environmental impact, addressing the chemical industry's focus on process intensification and waste minimization.

Regulatory status of Thiazole, 2,5-dimethyl-4-phenyl- varies by region, but it generally falls under standard chemical regulations rather than specialized controls. Manufacturers and users should consult current REACH or other regional chemical inventories for the latest compliance requirements, especially regarding workplace safety and environmental protection.

Future research directions for thiazole-based compounds like 19968-59-3 may explore their potential in catalysis or as ligands in coordination chemistry. The compound's structural features offer opportunities for creating novel metal-organic frameworks (MOFs) or other advanced materials, areas receiving significant research funding worldwide.

For researchers sourcing 2,5-dimethyl-4-phenylthiazole, important considerations include supplier reliability, batch-to-batch consistency, and available technical support. The compound is typically supplied in gram to kilogram quantities by specialty chemical providers catering to the research and development market segment.

In conclusion, Thiazole, 2,5-dimethyl-4-phenyl- (CAS No. 19968-59-3) represents an interesting example of functionalized thiazoles with diverse potential applications. Its study contributes to broader understanding of heterocyclic compound chemistry and enables development of new materials and bioactive molecules, making it relevant to multiple scientific and industrial fields.

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