HuagongsheHuagongshe Chemistry Print Report · For research reference only
(Z)-4-(2-nitrovinyl)phenol
Identifiers & Physical Properties
| CAS No. | 1082703-37-4 |
|---|---|
| Molecular formula | C8H7NO3 |
| Average molar mass | 165.15 g/mol |
| Monoisotopic mass | 165.04259309 g/mol |
| SMILES | O=[N+]([O-])/C=C\c1ccc(O)cc1 |
| InChIKey | CTJKRKMPTRJAIT-WAYWQWQTSA-N |
| PubChem CID | 15311368 |
| ChEMBL | CHEMBL3905482 |
Chemical & Physical Properties
| XLogP | 2.1 |
|---|---|
| Topological polar surface area | 66.1 |
| Hydrogen bond donors | 1 |
| Hydrogen bond acceptors | 3 |
| Rotatable bonds | 1 |
| Heavy atoms | 12 |
| Formal charge | 0 |
| Complexity | 177 |