HuagongsheHuagongshe Chemistry Print Report · For research reference only
Ethyl 3-phenyl-1,2-thiazole-4-carboxylate
Identifiers & Physical Properties
| CAS No. | 67049-00-7 |
|---|---|
| Molecular formula | C12H11NO2S |
| Average molar mass | 233.29 g/mol |
| Monoisotopic mass | 233.05104977 g/mol |
| SMILES | CCOC(=O)c1csnc1-c1ccccc1 |
| InChIKey | OIWFQDDZOVSDGS-UHFFFAOYSA-N |
| PubChem CID | 11368288 |
| DTXSID | DTXSID30463765 |
Chemical & Physical Properties
| XLogP | 2.9 |
|---|---|
| Topological polar surface area | 67.4 |
| Hydrogen bond donors | 0 |
| Hydrogen bond acceptors | 4 |
| Rotatable bonds | 4 |
| Heavy atoms | 16 |
| Formal charge | 0 |
| Complexity | 241 |