Base information
| Cat. No. | |
| CAS No. | 67856-50-2 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C14H9NO2 |
| Molecular Weight | 223.227 |
| Exact Mass | 223.063 |
| XLogP3 | 2.92348 |
| Mr | 63.5523 |
| PSA | 61.09 |
| Sequence | - |
| Atom number | 26 |
| Bond number | 27 |
| Ring number | 2 |
| Rotor number | 2 |
| Residues number | 0 |
| Canonical smiles | N#Cc1ccc(cc1)c1ccccc1C(=O)O |