Base information
| Cat. No. | |
| CAS No. | 7507-86-0 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C8H7BrO2 |
| Molecular Weight | 215.044 |
| Exact Mass | 213.963 |
| XLogP3 | 2.2702 |
| Mr | 46.0215 |
| PSA | 26.3 |
| Sequence | - |
| Atom number | 18 |
| Bond number | 18 |
| Ring number | 1 |
| Rotor number | 2 |
| Residues number | 0 |
| Canonical smiles | COc1ccc(c(c1)C=O)Br |
