Base information
| Cat. No. | |
| CAS No. | 28781-64-8 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C16H17N3O3 |
| Molecular Weight | 299.324 |
| Exact Mass | 299.127 |
| XLogP3 | 2.8845 |
| Mr | 93.53 |
| PSA | 78.49 |
| Sequence | - |
| Atom number | 39 |
| Bond number | 41 |
| Ring number | 3 |
| Rotor number | 2 |
| Residues number | 0 |
| Canonical smiles | O=C1CN=C(c2c(N1C)ccc(c2)[N+](=O)[O-])C1=CCCCC1 |
