Base information
| Cat. No. | |
| CAS No. | 101084-19-9 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C4H4BrNO |
| Molecular Weight | 161.985 |
| Exact Mass | 160.948 |
| XLogP3 | 1.7455 |
| Mr | 29.169 |
| PSA | 26.03 |
| Sequence | - |
| Atom number | 11 |
| Bond number | 11 |
| Ring number | 1 |
| Rotor number | 0 |
| Residues number | 0 |
| Canonical smiles | Brc1conc1C |
