Cas no 1049790-37-5 (4-(Chloromethyl)-2-4-(propan-2-yl)phenyl-1,3-thiazole Hydrochloride)

4-(Chloromethyl)-2-[4-(propan-2-yl)phenyl]-1,3-thiazole Hydrochloride is a chemically synthesized thiazole derivative with a chloromethyl functional group, offering reactivity for further modifications in organic synthesis. The presence of the isopropylphenyl moiety enhances its lipophilicity, making it useful in pharmaceutical and agrochemical intermediates. The hydrochloride salt form improves solubility and stability, facilitating handling and storage. This compound serves as a versatile building block for the development of biologically active molecules, particularly in medicinal chemistry for targeting thiazole-based scaffolds. Its structural features enable selective functionalization, supporting applications in drug discovery and material science. Proper handling under controlled conditions is recommended due to its reactive chloromethyl group.
4-(Chloromethyl)-2-4-(propan-2-yl)phenyl-1,3-thiazole Hydrochloride structure
1049790-37-5 structure
Product Name:4-(Chloromethyl)-2-4-(propan-2-yl)phenyl-1,3-thiazole Hydrochloride
CAS No:1049790-37-5
MF:C13H15Cl2NS
MW:288.235900163651
MDL:MFCD07287303
CID:842531
PubChem ID:16243664
Update Time:2025-10-17

4-(Chloromethyl)-2-4-(propan-2-yl)phenyl-1,3-thiazole Hydrochloride Chemical and Physical Properties

Names and Identifiers

    • 4-(CHLOROMETHYL)-2-(4-ISOPROPYLPHENYL)-1,3-THIAZOLE HYDROCHLORIDE
    • 4-(chloromethyl)-2-(4-propan-2-ylphenyl)-1,3-thiazole:hydrochloride
    • EN300-12159
    • Z56973506
    • 1049790-37-5
    • 4-(Chloromethyl)-2-(4-isopropylphenyl)thiazole hydrochloride
    • 4-(chloromethyl)-2-[4-(propan-2-yl)phenyl]-1,3-thiazole hydrochloride
    • G59347
    • J-513686
    • 4-(chloromethyl)-2-(4-propan-2-ylphenyl)-1,3-thiazole;hydrochloride
    • AKOS027427051
    • 4-(Chloromethyl)-2-(4-isopropylphenyl)thiazolehydrochloride
    • 4-(Chloromethyl)-2-4-(propan-2-yl)phenyl-1,3-thiazole Hydrochloride
    • MDL: MFCD07287303
    • Inchi: 1S/C13H14ClNS.ClH/c1-9(2)10-3-5-11(6-4-10)13-15-12(7-14)8-16-13;/h3-6,8-9H,7H2,1-2H3;1H
    • InChI Key: UYGNYLBJHALWCV-UHFFFAOYSA-N
    • SMILES: ClCC1=CSC(C2C=CC(=CC=2)C(C)C)=N1.Cl

Computed Properties

  • Exact Mass: 287.0302260g/mol
  • Monoisotopic Mass: 287.0302260g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 1
  • Heavy Atom Count: 17
  • Rotatable Bond Count: 3
  • Complexity: 214
  • Covalently-Bonded Unit Count: 2
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Topological Polar Surface Area: 41.1?2

4-(Chloromethyl)-2-4-(propan-2-yl)phenyl-1,3-thiazole Hydrochloride Pricemore >>

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4-(Chloromethyl)-2-4-(propan-2-yl)phenyl-1,3-thiazole Hydrochloride Related Literature

Additional information on 4-(Chloromethyl)-2-4-(propan-2-yl)phenyl-1,3-thiazole Hydrochloride

Comprehensive Overview of 4-(Chloromethyl)-2-4-(propan-2-yl)phenyl-1,3-thiazole Hydrochloride (CAS No. 1049790-37-5)

4-(Chloromethyl)-2-4-(propan-2-yl)phenyl-1,3-thiazole Hydrochloride (CAS No. 1049790-37-5) is a specialized organic compound that has garnered significant attention in pharmaceutical and agrochemical research. This thiazole derivative is characterized by its unique molecular structure, which includes a chloromethyl group and an isopropyl-substituted phenyl ring. These functional groups contribute to its reactivity and potential applications in drug discovery and material science. Researchers are particularly interested in its role as a building block for synthesizing more complex molecules, especially in the development of heterocyclic compounds with biological activity.

The compound's CAS No. 1049790-37-5 serves as a critical identifier in chemical databases, ensuring precise tracking in regulatory and research contexts. Its hydrochloride salt form enhances solubility, making it suitable for various experimental protocols. Recent studies highlight its potential in modulating enzyme activity and interacting with biological targets, aligning with the growing demand for small-molecule therapeutics. As the pharmaceutical industry shifts toward precision medicine, compounds like 4-(Chloromethyl)-2-4-(propan-2-yl)phenyl-1,3-thiazole Hydrochloride are increasingly explored for their structure-activity relationships (SAR).

In agrochemical applications, this thiazole derivative is investigated for its potential as a crop protection agent. With global concerns about food security and sustainable agriculture, researchers are evaluating its efficacy against plant pathogens while minimizing environmental impact. The compound's chloromethyl group may enable derivatization into novel pesticide candidates, addressing resistance issues in conventional agrochemicals.

From a synthetic chemistry perspective, CAS No. 1049790-37-5 exemplifies the versatility of thiazole scaffolds in modern organic synthesis. Its isopropylphenyl moiety introduces steric effects that can influence reaction pathways, a topic of interest in asymmetric catalysis. Laboratories focusing on green chemistry principles are also exploring solvent-free or catalytic methods to incorporate this compound into value-added products.

The compound's relevance extends to material science, where its aromatic-thiazole hybrid structure could contribute to organic semiconductors or luminescent materials. With the rise of flexible electronics, such molecular architectures are scrutinized for their charge transport properties and thermal stability.

Analytical characterization of 4-(Chloromethyl)-2-4-(propan-2-yl)phenyl-1,3-thiazole Hydrochloride typically involves HPLC purity analysis, mass spectrometry, and NMR spectroscopy. These techniques ensure batch-to-batch consistency, a critical factor for high-throughput screening in drug discovery. The compound's storage conditions and shelf life are frequently queried in scientific forums, reflecting practical concerns in laboratory management.

As regulatory landscapes evolve, CAS No. 1049790-37-5 is subject to REACH compliance assessments in the EU and analogous frameworks globally. Its safety data sheets (SDS) provide essential guidance for handling, though it is not classified among restricted substances. The compound's ecological impact remains an active research area, particularly regarding biodegradation pathways.

In conclusion, 4-(Chloromethyl)-2-4-(propan-2-yl)phenyl-1,3-thiazole Hydrochloride represents a multifaceted tool for researchers across disciplines. Its CAS No. 1049790-37-5 serves as a gateway to extensive scientific literature, while its structural features inspire innovation in medicinal chemistry, agrochemical development, and advanced materials. As interdisciplinary collaborations grow, this compound will likely feature in cutting-edge solutions to global challenges in health and sustainability.

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