Base information
| Cat. No. | |
| CAS No. | 53913-96-5 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C8H13BrO2 |
| Molecular Weight | 221.092 |
| Exact Mass | 220.01 |
| XLogP3 | 2.2792 |
| Mr | 49.289 |
| PSA | 26.3 |
| Sequence | - |
| Atom number | 24 |
| Bond number | 23 |
| Ring number | 0 |
| Rotor number | 4 |
| Residues number | 0 |
| Canonical smiles | BrCC(=C)C(=O)OC(C)(C)C |
