Base information
| Cat. No. | |
| CAS No. | 5657-19-2 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C7H7NO4 |
| Molecular Weight | 169.135 |
| Exact Mass | 169.038 |
| XLogP3 | 0.4849 |
| Mr | 38.283 |
| PSA | 79.54 |
| Sequence | - |
| Atom number | 19 |
| Bond number | 19 |
| Ring number | 1 |
| Rotor number | 4 |
| Residues number | 0 |
| Canonical smiles | OC(=O)CNC(=O)c1ccco1 |
