Base information
| Cat. No. | |
| CAS No. | 49851-31-2 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C11H13BrO |
| Molecular Weight | 241.124 |
| Exact Mass | 240.015 |
| XLogP3 | 3.4329 |
| Mr | 58.9275 |
| PSA | 17.07 |
| Sequence | - |
| Atom number | 26 |
| Bond number | 26 |
| Ring number | 1 |
| Rotor number | 4 |
| Residues number | 0 |
| Canonical smiles | CCCC(C(=O)c1ccccc1)Br |
