Base information
| Cat. No. | |
| CAS No. | 111773-13-8 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C12H13BrO2 |
| Molecular Weight | 269.134 |
| Exact Mass | 268.01 |
| XLogP3 | 2.985 |
| Mr | 61.127 |
| PSA | 18.46 |
| Sequence | - |
| Atom number | 28 |
| Bond number | 30 |
| Ring number | 3 |
| Rotor number | 0 |
| Residues number | 0 |
| Canonical smiles | Brc1ccc2c(c1)C1(CCC2)OCCO1 |
