HuagongsheHuagongshe Chemistry Print Report · For research reference only
alpha-Hydroxy-3-(azidomethyl)-4-hydroxybenzeneacetic acid
Identifiers & Physical Properties
| Molecular formula | C9H9N3O4 |
|---|---|
| Average molar mass | 223.19 g/mol |
| Monoisotopic mass | 223.05930578 g/mol |
| SMILES | [N-]=[N+]=NCc1cc(C(O)C(=O)O)ccc1O |
| InChIKey | XRSIYUYKZDOLQK-UHFFFAOYSA-N |
| PubChem CID | 20344779 |
Chemical & Physical Properties
| XLogP | 1.3 |
|---|---|
| Topological polar surface area | 92.1 |
| Hydrogen bond donors | 3 |
| Hydrogen bond acceptors | 6 |
| Rotatable bonds | 4 |
| Heavy atoms | 16 |
| Formal charge | 0 |
| Complexity | 303 |