Base information
| Cat. No. | |
| CAS No. | 84167-74-8 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C13H11BrO2 |
| Molecular Weight | 279.129 |
| Exact Mass | 277.994 |
| XLogP3 | 3.8135 |
| Mr | 68.3345 |
| PSA | 26.3 |
| Sequence | - |
| Atom number | 27 |
| Bond number | 28 |
| Ring number | 2 |
| Rotor number | 2 |
| Residues number | 0 |
| Canonical smiles | COc1ccc2c(c1Br)ccc(c2)C(=O)C |
