Base information
| Cat. No. | |
| CAS No. | 16732-09-5 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C12H13Br3O2 |
| Molecular Weight | 428.942 |
| Exact Mass | 425.847 |
| XLogP3 | 5.4598 |
| Mr | 80.269 |
| PSA | 26.3 |
| Sequence | - |
| Atom number | 30 |
| Bond number | 30 |
| Ring number | 1 |
| Rotor number | 6 |
| Residues number | 0 |
| Canonical smiles | CCCCCC(=O)Oc1c(Br)cc(cc1Br)Br |
