Base information
| Cat. No. | |
| CAS No. | 128312-69-6 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C6H9BrO |
| Molecular Weight | 177.039 |
| Exact Mass | 175.984 |
| XLogP3 | 1.7505 |
| Mr | 36.912 |
| PSA | 17.07 |
| Sequence | - |
| Atom number | 17 |
| Bond number | 17 |
| Ring number | 1 |
| Rotor number | 2 |
| Residues number | 0 |
| Canonical smiles | BrCC(=O)C1CCC1 |
