Base information
| Cat. No. | |
| CAS No. | 1194376-28-7 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C9H5BrO2 |
| Molecular Weight | 225.039 |
| Exact Mass | 223.947 |
| XLogP3 | 3.0078 |
| Mr | 49.3015 |
| PSA | 30.21 |
| Sequence | - |
| Atom number | 17 |
| Bond number | 18 |
| Ring number | 2 |
| Rotor number | 1 |
| Residues number | 0 |
| Canonical smiles | O=Cc1coc2c1cc(Br)cc2 |
