| CAS Number | 1820674-63-2 |
| Catalog Number | AG00I0S2 |
| Chemical Name | Ethyl 2-(2-ethoxy-2-oxoethyl)-1,3-thiazole-5-carboxylate |
| IUPAC Name | ethyl 2-(2-ethoxy-2-oxoethyl)-1,3-thiazole-5-carboxylate |
| InChI | InChI=1S/C10H13NO4S/c1-3-14-9(12)5-8-11-6-7(16-8)10(13)15-4-2/h6H,3-5H2,1-2H3 |
| InChI Key | MSVDOWGZYPQSCL-UHFFFAOYSA-N |
| MDL Number | MFCD28014031 |
| Molecular Formula | C10H13NO4S |
| Molecular Weight | 243.2795 |
| SMILES | CCOC(=O)Cc1ncc(s1)C(=O)OCC |
| Synonyms | 1820674-63-2,
Ethyl 2-(2-ethoxy-2-oxoethyl)thiazole-5-carboxylate,
ETHYL 2-(2-ETHOXY-2-OXOETHYL)-1,3-THIAZOLE-5-CARBOXYLATE,
AKOS027362989,
ZINC169725153,
|
| Complexity | 259 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 243.057g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 16 |
| Hydrogen Bond Acceptor Count | 6 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 243.277g/mol |
| Monoisotopic Mass | 243.057g/mol |
| Rotatable Bond Count | 7 |
| Topological Polar Surface Area | 93.7A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.7 |
GHS Hazard and Precautionary Statements
| Symbol: | |
|
Hazard statements
|
|
|
Precautionary statements
|
|
Certificate of Analysis
Lot Number