HuagongsheHuagongshe Chemistry Print Report · For research reference only
Ethyl 5-phenyl-1H-pyrrole-2-carboxylate
Identifiers & Physical Properties
| Molecular formula | C13H13NO2 |
|---|---|
| Average molar mass | 215.25 g/mol |
| Monoisotopic mass | 215.09462866 g/mol |
| SMILES | CCOC(=O)c1ccc(-c2ccccc2)[nH]1 |
| InChIKey | ZGHZLUUPMRXILE-UHFFFAOYSA-N |
| PubChem CID | 12378033 |
Chemical & Physical Properties
| XLogP | 2.9 |
|---|---|
| Topological polar surface area | 42.1 |
| Hydrogen bond donors | 1 |
| Hydrogen bond acceptors | 2 |
| Rotatable bonds | 4 |
| Heavy atoms | 16 |
| Formal charge | 0 |
| Complexity | 236 |