Base information
| Cat. No. | |
| CAS No. | 40894-00-6 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C5H11BrO |
| Molecular Weight | 167.044 |
| Exact Mass | 165.999 |
| XLogP3 | 1.3998 |
| Mr | 34.9208 |
| PSA | 20.23 |
| Sequence | - |
| Atom number | 18 |
| Bond number | 17 |
| Ring number | 0 |
| Rotor number | 2 |
| Residues number | 0 |
| Canonical smiles | OCC(CBr)(C)C |
