HuagongsheHuagongshe Chemistry Print Report · For research reference only
2-Propenoic acid, 3-(2-methoxy-5-nitrophenyl)-
Identifiers & Physical Properties
| CAS No. | 69447-75-2 |
|---|---|
| Molecular formula | C10H9NO5 |
| Average molar mass | 223.18 g/mol |
| SMILES | COc1ccc([N+](=O)[O-])cc1/C=C/C(=O)O |
| InChIKey | PTGPYHUXNRRNOM-GORDUTHDSA-N |
| PubChem CID | 6437745 |
Chemical & Physical Properties
| XLogP | 1.6 |
|---|---|
| Topological polar surface area | 92.4 |
| Hydrogen bond donors | 1 |
| Hydrogen bond acceptors | 5 |
| Rotatable bonds | 3 |
| Heavy atoms | 16 |
| Formal charge | 0 |
| Complexity | 296 |