Base information
| Cat. No. | |
| CAS No. | 121986-00-3 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C14H11NO2 |
| Molecular Weight | 225.243 |
| Exact Mass | 225.079 |
| XLogP3 | 3.03588 |
| Mr | 63.6418 |
| PSA | 53.25 |
| Sequence | - |
| Atom number | 28 |
| Bond number | 29 |
| Ring number | 2 |
| Rotor number | 3 |
| Residues number | 0 |
| Canonical smiles | N#C[C@@H](c1ccc(cc1)Oc1ccccc1)O |
