Base information
| Cat. No. | |
| CAS No. | 100-96-9 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C7H10N2O |
| Molecular Weight | 138.167 |
| Exact Mass | 138.079 |
| XLogP3 | 2.022 |
| Mr | 41.7428 |
| PSA | 61.27 |
| Sequence | - |
| Atom number | 20 |
| Bond number | 20 |
| Ring number | 1 |
| Rotor number | 1 |
| Residues number | 0 |
| Canonical smiles | COc1cc(N)cc(c1)N |
