Cas no 79836-78-5 (ethyl 2-methyl-1,3-thiazole-5-carboxylate)
ethyl 2-methyl-1,3-thiazole-5-carboxylate Chemical and Physical Properties
Names and Identifiers
-
- Ethyl 2-methylthiazole-5-carboxylate
- 2-Methylthiazole-5-carboxylic acid ethyl ester
- ETHYL 2-METHYL-1,3-THIAZOLE-5-CARBOXYLATE
- 2-Methyl-Thiazole-5-Carboxylic Acid Ethyl Ester
- Ethyl 2-methyl-thiazole-5-carboxylate
- ETHYL 2-METHYL-5-THIAZOLECARBOXYLATE
- 2-MethylThiazole-5-Carboxylicacidethylester
- ORCQTMZHDQSNOJ-UHFFFAOYSA-N
- SBB053908
- ethyl 2-methyl-5-thiazole carboxylate
- CS-W005912
- 79836-78-5
- DTXSID60510392
- AMY24776
- J-520778
- 5-Thiazolecarboxylic acid, 2-methyl-, ethyl ester
- AC-24500
- PB30777
- A9932
- Ethyl2-methylthiazole-5-carboxylate
- AKOS005259668
- 2-Methyl-5-thiazolecarboxylic acid ethyl ester
- SY033439
- CS-10940
- SCHEMBL286068
- FT-0600175
- MFCD03840442
- PS-3935
- 2-Methyl-1,3-thiazole-5-carboxylic acid ethyl ester
- 2-Methyl-5-ethoxycarbonylthiazole
- DB-011544
- ethyl 2-methyl-1,3-thiazole-5-carboxylate
-
- MDL: MFCD03840442
- Inchi: 1S/C7H9NO2S/c1-3-10-7(9)6-4-8-5(2)11-6/h4H,3H2,1-2H3
- InChI Key: ORCQTMZHDQSNOJ-UHFFFAOYSA-N
- SMILES: O=C(C1=CN=C(C)S1)OCC
Computed Properties
- Exact Mass: 171.03500
- Monoisotopic Mass: 171.03539970g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 11
- Rotatable Bond Count: 3
- Complexity: 151
- 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
- Surface Charge: 0
- Tautomer Count: nothing
- XLogP3: 1.9
- Topological Polar Surface Area: 67.4
Experimental Properties
- Color/Form: Colorless or light yellow liquid.
- Density: 1.199
- Boiling Point: 242.1°C at 760 mmHg
- Flash Point: 100.235°C
- Refractive Index: 1.528
- PSA: 67.43000
- LogP: 1.62820
- Solubility: Almost insoluble in water, soluble in alcohols, acetone.
ethyl 2-methyl-1,3-thiazole-5-carboxylate Security Information
- Signal Word:Warning
- Hazard Statement: H302-H315-H319-H335
- Warning Statement: P261-P305+P351+P338
- Storage Condition:Sealed in dry,Room Temperature
ethyl 2-methyl-1,3-thiazole-5-carboxylate Customs Data
- HS CODE:2934100090
- Customs Data:
China Customs Code:
2934100090Overview:
2934100090. Compounds that structurally contain a non fused thiazole ring(Whether hydrogenated or not). VAT:17.0%. Tax refund rate:9.0%. Regulatory conditions:nothing. MFN tariff:6.5%. general tariff:20.0%
Declaration elements:
Product Name, component content, use to
Summary:
2934100090 other compounds containing an unfused thiazole ring (whether or not hydrogenated) in the structure VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:6.5% General tariff:20.0%
ethyl 2-methyl-1,3-thiazole-5-carboxylate Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| Fluorochem | 066961-1g |
Ethyl 2-Methyl-1,3-thiazole-5-carboxylate |
79836-78-5 | 97% | 1g |
£31.00 | 2022-03-01 | |
| Fluorochem | 066961-5g |
Ethyl 2-Methyl-1,3-thiazole-5-carboxylate |
79836-78-5 | 97% | 5g |
£124.00 | 2022-03-01 | |
| Fluorochem | 066961-10g |
Ethyl 2-Methyl-1,3-thiazole-5-carboxylate |
79836-78-5 | 97% | 10g |
£223.00 | 2022-03-01 | |
| Fluorochem | 066961-25g |
Ethyl 2-Methyl-1,3-thiazole-5-carboxylate |
79836-78-5 | 97% | 25g |
£437.00 | 2022-03-01 | |
| ChemScence | CS-W005912-1g |
Ethyl 2-methylthiazole-5-carboxylate |
79836-78-5 | 99.25% | 1g |
$44.0 | 2022-04-26 | |
| ChemScence | CS-W005912-5g |
Ethyl 2-methylthiazole-5-carboxylate |
79836-78-5 | 99.25% | 5g |
$138.0 | 2022-04-26 | |
| ChemScence | CS-W005912-10g |
Ethyl 2-methylthiazole-5-carboxylate |
79836-78-5 | 99.25% | 10g |
$265.0 | 2022-04-26 | |
| ChemScence | CS-W005912-25g |
Ethyl 2-methylthiazole-5-carboxylate |
79836-78-5 | 99.25% | 25g |
$585.0 | 2022-04-26 | |
| SHANG HAI MAI KE LIN SHENG HUA Technology Co., Ltd. | E825126-5g |
Ethyl 2-methylthiazole-5-carboxylate |
79836-78-5 | ≥95% | 5g |
1,168.20 | 2021-05-17 | |
| Chemenu | CM100748-5g |
ethyl 2-methylthiazole-5-carboxylate |
79836-78-5 | 98% | 5g |
$149 | 2021-08-06 |
ethyl 2-methyl-1,3-thiazole-5-carboxylate Production Method
Production Method 1
Production Method 2
ethyl 2-methyl-1,3-thiazole-5-carboxylate Raw materials
- Thioacetamide
- 4-Isoxazolecarboxylic acid, 2,5-dihydro-5-oxo-2-phenyl-, ethyl ester
- ethyl 2-chloro-3-oxo-propanoate
ethyl 2-methyl-1,3-thiazole-5-carboxylate Preparation Products
ethyl 2-methyl-1,3-thiazole-5-carboxylate Suppliers
ethyl 2-methyl-1,3-thiazole-5-carboxylate Related Literature
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Long Deng,Qian Zou,Biao Liu,Wenhui Ye,Chengfei Zhuo,Li Chen,Ze-Yuan Deng,Ya-Wei Fan,Jing Li Food Funct., 2018,9, 4234-4245
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Shintaro Takata,Yoshihiro Miura Phys. Chem. Chem. Phys., 2014,16, 24784-24789
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Zhiyan Chen,Nan Wu,Yaobing Wang,Bing Wang,Yingde Wang J. Mater. Chem. A, 2018,6, 516-526
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Denis V. Korchagin,Elena A. Yureva,Alexander V. Akimov,Eugenii Ya. Misochko,Gennady V. Shilov,Artem D. Talantsev,Roman B. Morgunov,Alexander A. Shakin,Sergey M. Aldoshin,Boris S. Tsukerblat Dalton Trans., 2017,46, 7540-7548
Additional information on ethyl 2-methyl-1,3-thiazole-5-carboxylate
Comprehensive Overview of Ethyl 2-Methyl-1,3-Thiazole-5-Carboxylate (CAS No. 79836-78-5)
Ethyl 2-methyl-1,3-thiazole-5-carboxylate (CAS No. 79836-78-5) is a versatile organic compound widely utilized in pharmaceutical, agrochemical, and flavor/fragrance industries. This thiazole derivative features a carboxylate ester group, making it a valuable intermediate for synthesizing bioactive molecules. Its molecular formula, C7H9NO2S, and unique structure contribute to its reactivity and applicability in diverse chemical transformations.
The growing demand for heterocyclic compounds like ethyl 2-methyl-1,3-thiazole-5-carboxylate is driven by their role in drug discovery. Researchers frequently search for "thiazole derivatives in medicinal chemistry" or "CAS 79836-78-5 applications," reflecting its relevance in developing antiviral and anti-inflammatory agents. Recent studies highlight its potential as a building block for kinase inhibitors, aligning with trends in targeted cancer therapies.
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The flavor industry leverages ethyl 2-methyl-1,3-thiazole-5-carboxylate for its aromatic properties. Searches for "food-grade thiazole compounds" or "natural flavor enhancers" correlate with its use in replicating savory notes in processed foods. This aligns with consumer trends toward clean-label ingredients and plant-based alternatives.
From a synthetic perspective, the compound’s ester functionality enables facile modifications. Chemists exploring "regioselective thiazole reactions" or "79836-78-5 derivatives" value its adaptability in nucleophilic substitutions and cross-coupling reactions. Its stability under mild conditions makes it preferable for scalable production.
Environmental and regulatory considerations are increasingly prominent. Queries like "biodegradable thiazole compounds" reflect the shift toward sustainable chemistry. Ethyl 2-methyl-1,3-thiazole-5-carboxylate meets many green chemistry metrics due to its low toxicity profile and compatibility with catalytic processes.
Analytical methods for characterizing this compound, such as GC-MS and HPLC, are frequently discussed in "CAS 79836-78-5 purity analysis" searches. Quality control protocols emphasize the importance of identifying isomers and byproducts, ensuring consistency in industrial applications.
Future research directions include exploring its role in "smart materials" and "bioelectronic interfaces," given the thiazole ring’s electron-rich nature. Such innovations could expand its utility beyond traditional sectors, catering to next-gen technologies.
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