Base information
| Cat. No. | |
| CAS No. | 1003708-34-6 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C10H12N2O |
| Molecular Weight | 176.215 |
| Exact Mass | 176.095 |
| XLogP3 | 2.29268 |
| Mr | 51.8264 |
| PSA | 59.04 |
| Sequence | - |
| Atom number | 25 |
| Bond number | 25 |
| Ring number | 1 |
| Rotor number | 2 |
| Residues number | 0 |
| Canonical smiles | CCc1cc(N)cc(c1OC)C#N |
