HuagongsheHuagongshe Chemistry Print Report · For research reference only
methyl (2E)-3-(4-formylthiophen-2-yl)acrylate
Identifiers & Physical Properties
| Molecular formula | C9H8O3S |
|---|---|
| Average molar mass | 196.22 g/mol |
| SMILES | COC(=O)/C=C/c1cc(C=O)cs1 |
| InChIKey | WQUPFOHQSFCVKG-NSCUHMNNSA-N |
| PubChem CID | 86650009 |
Chemical & Physical Properties
| XLogP | 1.4 |
|---|---|
| Topological polar surface area | 71.6 |
| Hydrogen bond donors | 0 |
| Hydrogen bond acceptors | 4 |
| Rotatable bonds | 4 |
| Heavy atoms | 13 |
| Formal charge | 0 |
| Complexity | 225 |