Base information
| Cat. No. | |
| CAS No. | 1218526-50-1 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C9H10BrNO3 |
| Molecular Weight | 260.085 |
| Exact Mass | 258.984 |
| XLogP3 | 2.2424 |
| Mr | 54.8862 |
| PSA | 72.55 |
| Sequence | - |
| Atom number | 24 |
| Bond number | 24 |
| Ring number | 1 |
| Rotor number | 3 |
| Residues number | 0 |
| Canonical smiles | COc1ccc(cc1Br)C(C(=O)O)N |
