Base information
| Cat. No. | |
| CAS No. | 1219-14-3 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C14H8N2O2 |
| Molecular Weight | 236.226 |
| Exact Mass | 236.059 |
| XLogP3 | 3.07336 |
| Mr | 64.36 |
| PSA | 66.04 |
| Sequence | - |
| Atom number | 26 |
| Bond number | 27 |
| Ring number | 2 |
| Rotor number | 3 |
| Residues number | 0 |
| Canonical smiles | N#COc1ccc(cc1)c1ccc(cc1)OC#N |
