Base information
| Cat. No. | |
| CAS No. | 2204-97-9 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C12H13BrO |
| Molecular Weight | 253.135 |
| Exact Mass | 252.015 |
| XLogP3 | 3.822 |
| Mr | 61.4505 |
| PSA | 17.07 |
| Sequence | - |
| Atom number | 27 |
| Bond number | 28 |
| Ring number | 2 |
| Rotor number | 2 |
| Residues number | 0 |
| Canonical smiles | O=C(c1ccc(cc1)Br)C1CCCC1 |
