Base information
| Cat. No. | |
| CAS No. | 1000018-13-2 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C11H14BrNO2 |
| Molecular Weight | 272.138 |
| Exact Mass | 271.021 |
| XLogP3 | 3.5225 |
| Mr | 64.4059 |
| PSA | 52.32 |
| Sequence | - |
| Atom number | 29 |
| Bond number | 29 |
| Ring number | 1 |
| Rotor number | 3 |
| Residues number | 0 |
| Canonical smiles | COC(=O)c1cc(Br)c(cc1N)C(C)C |
