| Pubchem Sid | 488195053 |
|---|---|
| Canonical Smiles | CCOC(=O)C1=CSC=N1 |
| IUPAC Name | ethyl 1,3-thiazole-4-carboxylate |
| InChIKey | XDOKFEJMEJKVGX-UHFFFAOYSA-N |
| INCHI | 1S/C6H7NO2S/c1-2-9-6(8)5-3-10-4-7-5/h3-4H,2H2,1H3 |
| Isomeric SMILES | CCOC(=O)C1=CSC=N1 |
| WGK Germany | 3 |
| Molecular Weight | 157.19 |
| Reaxy-Rn | 115771 |
| Reaxys-RN_link_address | https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=115771&ln= |
Comprehensive hazard, handling, storage, and regulatory compliance document.
Download SDS →Lot-specific quality data. Enter your lot number to retrieve the exact COA.
Look up COA →Full quality attributes and acceptance criteria for this grade.
View spec sheet →Taxonomy Tree
| Kingdom | Organic compounds |
|---|---|
| Superclass | Organoheterocyclic compounds |
| Class | Azoles |
| Subclass | Thiazoles |
| Intermediate Tree Nodes | Not available |
| Direct Parent | Thiazolecarboxylic acids and derivatives |
| Alternative Parents | Heteroaromatic compounds Carboxylic acid esters Azacyclic compounds Organooxygen compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives |
| Molecular Framework | Aromatic heteromonocyclic compounds |
| Substituents | Thiazolecarboxylic acid or derivatives - Heteroaromatic compound - Carboxylic acid ester - Azacycle - Carboxylic acid derivative - Organic nitrogen compound - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Aromatic heteromonocyclic compound |
| Description | This compound belongs to the class of organic compounds known as thiazolecarboxylic acids and derivatives. These are heterocyclic compounds containing a thiazole ring which bears a carboxylic acid group (or a derivative thereof). |
| External Descriptors | Not available |
Find and download the COA for your product by matching the lot number on the packaging.
| Lot Number | Certificate Type | Date | Item |
|---|---|---|---|
 L2524040 | Certificate of Analysis | Dec 30, 2025 | E131979 |
| F1912174 | Certificate of Analysis | Apr 11, 2023 | E131979 |
| E2316670 | Certificate of Analysis | Mar 02, 2023 | E131979 |
| E2316675 | Certificate of Analysis | Mar 02, 2023 | E131979 |
| E2316676 | Certificate of Analysis | Mar 02, 2023 | E131979 |
| E2316677 | Certificate of Analysis | Mar 02, 2023 | E131979 |
| E2316679 | Certificate of Analysis | Mar 02, 2023 | E131979 |
| E2316680 | Certificate of Analysis | Mar 02, 2023 | E131979 |
| E2316683 | Certificate of Analysis | Mar 02, 2023 | E131979 |
| E2316684 | Certificate of Analysis | Mar 02, 2023 | E131979 |
| L2208452 | Certificate of Analysis | Dec 22, 2022 | E131979 |
| L2201334 | Certificate of Analysis | Dec 16, 2022 | E131979 |
| Flash Point(°F) | >230 °F |
|---|---|
| Flash Point(°C) | >110 °C |
| Melt Point(°C) | 51-55℃ |
| Molecular Weight | 157.190 g/mol |
| XLogP3 | 1.500 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 3 |
| Exact Mass | 157.02 Da |
| Monoisotopic Mass | 157.02 Da |
| Topological Polar Surface Area | 67.400 Ų |
| Heavy Atom Count | 10 |
| Formal Charge | 0 |
| Complexity | 129.000 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| The total count of all stereochemical bonds | 0 |
| Covalently-Bonded Unit Count | 1 |
