Base information
| Cat. No. | |
| CAS No. | 481668-37-5 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C11H10N2O |
| Molecular Weight | 186.21 |
| Exact Mass | 186.079 |
| XLogP3 | 2.35658 |
| Mr | 54.4717 |
| PSA | 48.81 |
| Sequence | - |
| Atom number | 24 |
| Bond number | 25 |
| Ring number | 2 |
| Rotor number | 1 |
| Residues number | 0 |
| Canonical smiles | COc1ccc2c(c1)c(C#N)c([nH]2)C |
