Base information
| Cat. No. | |
| CAS No. | 1097199-51-3 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C10H7NO2 |
| Molecular Weight | 173.168 |
| Exact Mass | 173.048 |
| XLogP3 | 2.1541 |
| Mr | 47.3265 |
| PSA | 43.1 |
| Sequence | - |
| Atom number | 20 |
| Bond number | 21 |
| Ring number | 2 |
| Rotor number | 2 |
| Residues number | 0 |
| Canonical smiles | O=Cc1cccc(c1)c1cnco1 |
