Cas no 19989-64-1 (Ethyl benzo[d]thiazole-6-carboxylate)

Ethyl benzo[d]thiazole-6-carboxylate is a heterocyclic ester compound featuring a benzo[d]thiazole core with a carboxylate functional group at the 6-position. This structure imparts versatility in organic synthesis, particularly in the preparation of pharmaceuticals, agrochemicals, and functional materials. The ethyl ester moiety enhances solubility in organic solvents, facilitating further derivatization. Its benzo[d]thiazole scaffold is notable for its electron-rich aromatic system, making it useful in coordination chemistry and as a building block for bioactive molecules. The compound's stability under standard conditions and well-defined reactivity profile make it a reliable intermediate for research and industrial applications.
Ethyl benzo[d]thiazole-6-carboxylate structure
19989-64-1 structure
Product Name:Ethyl benzo[d]thiazole-6-carboxylate
CAS No:19989-64-1
MF:C10H9NO2S
MW:207.248961210251
MDL:MFCD02089769
CID:123880
PubChem ID:10512520
Update Time:2025-11-02

Ethyl benzo[d]thiazole-6-carboxylate Chemical and Physical Properties

Names and Identifiers

    • Ethyl benzo[d]thiazole-6-carboxylate
    • 6-Benzothiazolecarboxylic acid ethyl ester
    • ethyl 1,3-benzothiazole-6-carboxylate
    • 6-ethoxycarbonylbenzothiazole
    • Benzothiazol-6-carbonsaeure-aethylester
    • benzothiazole-6-carboxylic acid ethyl ester
    • Ethyl benzothiazole-6-carboxylate
    • A23718
    • 6-Benzothiazolecarboxylic acid, ethyl ester
    • 19989-64-1
    • ethylbenzo[d]thiazole-6-carboxylate
    • CS-0096144
    • AKOS005259778
    • AYOJYVVHVFIOLK-UHFFFAOYSA-N
    • MFCD02089769
    • DTXSID30441048
    • AS-69278
    • 6-Benzothiazolecarboxylicacid,ethylester(6CI,8CI,9CI)
    • SY317243
    • SCHEMBL2665689
    • InChI=1/C10H9NO2S/c1-2-13-10(12)7-3-4-8-9(5-7)14-6-11-8/h3-6H,2H2,1H
    • FT-0736110
    • DB-012431
    • MDL: MFCD02089769
    • Inchi: 1S/C10H9NO2S/c1-2-13-10(12)7-3-4-8-9(5-7)14-6-11-8/h3-6H,2H2,1H3
    • InChI Key: AYOJYVVHVFIOLK-UHFFFAOYSA-N
    • SMILES: S1C=NC2C=CC(C(=O)OCC)=CC1=2

Computed Properties

  • Exact Mass: 207.03500
  • Monoisotopic Mass: 207.03539970g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 14
  • Rotatable Bond Count: 3
  • Complexity: 222
  • 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: 2.6
  • Topological Polar Surface Area: 67.4?2

Experimental Properties

  • PSA: 67.43000
  • LogP: 2.47300

Ethyl benzo[d]thiazole-6-carboxylate Customs Data

  • HS CODE:2934200090
  • Customs Data:

    China Customs Code:

    2934200090

    Overview:

    2934200090. Other compounds containing a benzothiazole ring. VAT:17.0%. Tax refund rate:13.0%. Regulatory conditions:nothing. MFN tariff:6.5%. general tariff:20.0%

    Declaration elements:

    Product Name, component content, use to

    Summary:

    2934200090. other compounds containing in the structure a benzothiazole ring-system (whether or not hydrogenated), not further fused. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

Ethyl benzo[d]thiazole-6-carboxylate Pricemore >>

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Ethyl benzo[d]thiazole-6-carboxylate Suppliers

Amadis Chemical Company Limited
Gold Member
Audited Supplier Audited Supplier
(CAS:19989-64-1)Ethyl benzo[d]thiazole-6-carboxylate
Order Number:A23718
Stock Status:in Stock
Quantity:5g/25g
Purity:99%
Pricing Information Last Updated:Monday, 2 September 2024 16:02
Price ($):481.0/2402.0

Additional information on Ethyl benzo[d]thiazole-6-carboxylate

Comprehensive Guide to Ethyl benzo[d]thiazole-6-carboxylate (CAS No. 19989-64-1): Properties, Applications, and Market Insights

Ethyl benzo[d]thiazole-6-carboxylate (CAS No. 19989-64-1) is a specialized organic compound widely recognized for its unique chemical structure and versatile applications in pharmaceuticals, agrochemicals, and material science. This ester derivative of benzo[d]thiazole has garnered significant attention due to its role as a key intermediate in synthesizing bioactive molecules. With the growing demand for heterocyclic compounds in drug discovery, understanding the properties and uses of Ethyl benzo[d]thiazole-6-carboxylate is essential for researchers and industry professionals.

The molecular formula of Ethyl benzo[d]thiazole-6-carboxylate is C10H9NO2S, featuring a benzothiazole core with an ester functional group at the 6-position. This configuration imparts distinct reactivity, making it valuable for cross-coupling reactions and organocatalysis. Recent studies highlight its potential in designing fluorescent probes and OLED materials, aligning with the global push for advanced optoelectronic devices.

In pharmaceuticals, Ethyl benzo[d]thiazole-6-carboxylate serves as a precursor for kinase inhibitors and antimicrobial agents. Its scaffold is frequently employed in medicinal chemistry to enhance drug bioavailability. A 2023 Journal of Medicinal Chemistry study emphasized its utility in developing anticancer candidates, particularly targeting protein-protein interactions. This aligns with trending searches like "benzothiazole derivatives in cancer therapy" and "heterocyclic compounds for drug design," reflecting industry interest.

The agrochemical sector utilizes Ethyl benzo[d]thiazole-6-carboxylate to synthesize crop protection agents. Its derivatives exhibit herbicidal and fungicidal properties, addressing the demand for sustainable pesticides—a hot topic given the EU's 2030 Farm-to-Fork strategy. Researchers are exploring its potential in green chemistry applications, such as biodegradable plant growth regulators, responding to queries like "eco-friendly agrochemical intermediates."

From a commercial perspective, the global market for benzothiazole-based compounds is projected to grow at a CAGR of 5.8% (2023–2030), driven by Asia-Pacific's pharmaceutical boom. Suppliers of Ethyl benzo[d]thiazole-6-carboxylate are increasingly adopting continuous flow chemistry to improve yield—a technique frequently searched alongside "scaling up heterocyclic synthesis." Regulatory compliance (e.g., REACH, FDA GMP) remains a critical consideration, as noted in recent LinkedIn discussions on specialty chemical sourcing.

Innovations in catalytic esterification have optimized the production of Ethyl benzo[d]thiazole-6-carboxylate, reducing byproducts. A 2024 ACS Sustainable Chemistry paper demonstrated a solvent-free method using enzyme-mimetic catalysts, resonating with searches for "energy-efficient chemical processes." These advancements support SDG 12 (Responsible Consumption), a key focus in ESG-driven investments.

Analytical characterization of Ethyl benzo[d]thiazole-6-carboxylate typically involves HPLC-MS and NMR spectroscopy. A recent Analytical Methods article highlighted a novel UPLC-PDA protocol for purity assessment—information highly sought after in forums like ResearchGate. Proper storage recommendations (2–8°C under inert atmosphere) are crucial, as stability data feature prominently in chemical procurement inquiries.

Future research directions include exploring metal-organic frameworks (MOFs) incorporating Ethyl benzo[d]thiazole-6-carboxylate for gas storage—a topic gaining traction in materials science circles. Patent analysis reveals growing IP activity around its polymeric applications, particularly in self-healing coatings, answering queries like "smart materials from heterocycles."

In summary, Ethyl benzo[d]thiazole-6-carboxylate (CAS No. 19989-64-1) represents a multifaceted compound bridging pharmaceutical innovation, sustainable agriculture, and advanced materials. Its evolving applications underscore the importance of structural diversification in modern chemistry, making it a compound to watch in both academic and industrial settings.

Recommended suppliers
Amadis Chemical Company Limited
(CAS:19989-64-1)Ethyl benzo[d]thiazole-6-carboxylate
A23718
Purity:99%/99%
Quantity:5g/25g
Price ($):481.0/2402.0
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