Base information
| Cat. No. | |
| CAS No. | 120807-28-5 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C12H12N2O |
| Molecular Weight | 200.236 |
| Exact Mass | 200.095 |
| XLogP3 | 1.79258 |
| Mr | 60.806 |
| PSA | 44.1 |
| Sequence | - |
| Atom number | 27 |
| Bond number | 28 |
| Ring number | 2 |
| Rotor number | 1 |
| Residues number | 0 |
| Canonical smiles | N#Cc1ccccc1N1CCC(=O)CC1 |
