Base information
| Cat. No. | |
| CAS No. | 5731-11-3 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C13H9BrO2 |
| Molecular Weight | 277.113 |
| Exact Mass | 275.979 |
| XLogP3 | 3.8143 |
| Mr | 66.5373 |
| PSA | 37.3 |
| Sequence | - |
| Atom number | 25 |
| Bond number | 26 |
| Ring number | 2 |
| Rotor number | 2 |
| Residues number | 0 |
| Canonical smiles | Brc1ccc(cc1)c1ccc(cc1)C(=O)O |
