Cas no 19989-64-1 (Ethyl benzo[d]thiazole-6-carboxylate)
Ethyl benzo[d]thiazole-6-carboxylate Chemical and Physical Properties
Names and Identifiers
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- 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:
2934200090Overview:
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 >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| Fluorochem | 210641-1g |
Ethyl benzo[d]thiazole-6-carboxylate |
19989-64-1 | 95% | 1g |
£113.00 | 2022-03-01 | |
| Fluorochem | 210641-5g |
Ethyl benzo[d]thiazole-6-carboxylate |
19989-64-1 | 95% | 5g |
£435.00 | 2022-03-01 | |
| SHANG HAI BI DE YI YAO KE JI GU FEN Co., Ltd. | BD161936-100mg |
Ethyl benzo[d]thiazole-6-carboxylate |
19989-64-1 | 97% | 100mg |
¥689.0 | 2022-03-01 | |
| SHANG HAI BI DE YI YAO KE JI GU FEN Co., Ltd. | BD161936-250mg |
Ethyl benzo[d]thiazole-6-carboxylate |
19989-64-1 | 97% | 250mg |
¥1146.0 | 2022-03-01 | |
| SHANG HAI BI DE YI YAO KE JI GU FEN Co., Ltd. | BD161936-1g |
Ethyl benzo[d]thiazole-6-carboxylate |
19989-64-1 | 97% | 1g |
¥2519.0 | 2022-03-01 | |
| SHANG HAI BI DE YI YAO KE JI GU FEN Co., Ltd. | BD161936-5g |
Ethyl benzo[d]thiazole-6-carboxylate |
19989-64-1 | 97% | 5g |
¥8929.0 | 2022-03-01 | |
| SHANG HAI JI ZHI SHENG HUA Technology Co., Ltd. | E85690-1g |
Ethyl benzo[d]thiazole-6-carboxylate |
19989-64-1 | 97% | 1g |
¥414.0 | 2023-09-07 | |
| SHANG HAI JI ZHI SHENG HUA Technology Co., Ltd. | E85690-5g |
Ethyl benzo[d]thiazole-6-carboxylate |
19989-64-1 | 97% | 5g |
¥2067.0 | 2023-09-07 | |
| SHANG HAI JI ZHI SHENG HUA Technology Co., Ltd. | E85690-250mg |
Ethyl benzo[d]thiazole-6-carboxylate |
19989-64-1 | 97% | 250mg |
¥119.0 | 2023-09-07 | |
| SHANG HAI JI ZHI SHENG HUA Technology Co., Ltd. | E85690-100mg |
Ethyl benzo[d]thiazole-6-carboxylate |
19989-64-1 | 97% | 100mg |
¥50.0 | 2023-09-07 |
Ethyl benzo[d]thiazole-6-carboxylate Suppliers
Ethyl benzo[d]thiazole-6-carboxylate Related Literature
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Supaporn Sawadjoon,Joseph S. M. Samec Org. Biomol. Chem., 2011,9, 2548-2554
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Bidyut Kumar Kundu,Rinky Singh,Ritudhwaj Tiwari,Debasis Nayak New J. Chem., 2019,43, 4867-4877
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Hamid Heydari,Mohammad B. Gholivand New J. Chem., 2017,41, 237-244
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.
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