Base information
| Cat. No. | |
| CAS No. | 20012-10-6 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C16H18BrNO2 |
| Molecular Weight | 336.224 |
| Exact Mass | 335.052 |
| XLogP3 | 3.6623 |
| Mr | 89.1627 |
| PSA | 52.49 |
| Sequence | - |
| Atom number | 38 |
| Bond number | 39 |
| Ring number | 3 |
| Rotor number | 1 |
| Residues number | 0 |
| Canonical smiles | Oc1cc2CCNCC(c2cc1O)c1ccccc1.Br |
