Base information
| Cat. No. | |
| CAS No. | 1221885-61-5 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C11H7D6NO2 |
| Molecular Weight | 197.263 |
| Exact Mass | 197.132 |
| XLogP3 | 1.1144 |
| Mr | 59.062 |
| PSA | 30.82 |
| Sequence | - |
| Atom number | 27 |
| Bond number | 28 |
| Ring number | 2 |
| Rotor number | 2 |
| Residues number | 0 |
| Canonical smiles | [2H]C(Oc1cc2C=NCCc2cc1OC([2H])([2H])[2H])([2H])[2H] |