HuagongsheHuagongshe Chemistry Print Report · For research reference only
4-Benzyloxy-3-nitrophenethylamine
Identifiers & Physical Properties
| Molecular formula | C15H16N2O3 |
|---|---|
| Average molar mass | 272.3 g/mol |
| Monoisotopic mass | 272.11609238 g/mol |
| SMILES | NCCc1ccc(OCc2ccccc2)c([N+](=O)[O-])c1 |
| InChIKey | GXKARSPICGVIAO-UHFFFAOYSA-N |
| PubChem CID | 19082296 |
Chemical & Physical Properties
| XLogP | 2.5 |
|---|---|
| Topological polar surface area | 81.1 |
| Hydrogen bond donors | 1 |
| Hydrogen bond acceptors | 4 |
| Rotatable bonds | 5 |
| Heavy atoms | 20 |
| Formal charge | 0 |
| Complexity | 300 |