Base information
| Cat. No. | |
| CAS No. | 661489-22-1 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C11H12N2 |
| Molecular Weight | 172.226 |
| Exact Mass | 172.1 |
| XLogP3 | 3.00358 |
| Mr | 55.4254 |
| PSA | 49.81 |
| Sequence | - |
| Atom number | 25 |
| Bond number | 25 |
| Ring number | 1 |
| Rotor number | 1 |
| Residues number | 0 |
| Canonical smiles | N#C/C=C\c1cc(C)c(c(c1)C)N |
