Base information
| Cat. No. | |
| CAS No. | 1514-11-0 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C8H6BrF3O |
| Molecular Weight | 255.032 |
| Exact Mass | 253.955 |
| XLogP3 | 3.4765 |
| Mr | 45.636 |
| PSA | 9.23 |
| Sequence | - |
| Atom number | 19 |
| Bond number | 19 |
| Ring number | 1 |
| Rotor number | 2 |
| Residues number | 0 |
| Canonical smiles | COc1ccc(cc1C(F)(F)F)Br |
