Base information
| Cat. No. | |
| CAS No. | 169508-94-5 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C10H7NO3 |
| Molecular Weight | 189.167 |
| Exact Mass | 189.043 |
| XLogP3 | 2.0398 |
| Mr | 48.8983 |
| PSA | 63.33 |
| Sequence | - |
| Atom number | 21 |
| Bond number | 22 |
| Ring number | 2 |
| Rotor number | 2 |
| Residues number | 0 |
| Canonical smiles | OC(=O)c1ccccc1c1cnco1 |
