Base information
| Cat. No. | |
| CAS No. | 36194-82-8 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C8H7BrO3 |
| Molecular Weight | 231.043 |
| Exact Mass | 229.958 |
| XLogP3 | 2.1613 |
| Mr | 48.0903 |
| PSA | 57.53 |
| Sequence | - |
| Atom number | 19 |
| Bond number | 19 |
| Ring number | 1 |
| Rotor number | 1 |
| Residues number | 0 |
| Canonical smiles | Brc1cc(C)c(c(c1)C(=O)O)O |
