Base information
| Cat. No. | |
| CAS No. | 129541-43-1 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C12H11BrClNO2 |
| Molecular Weight | 316.578 |
| Exact Mass | 314.966 |
| XLogP3 | 4.2893 |
| Mr | 72.1217 |
| PSA | 42.09 |
| Sequence | - |
| Atom number | 28 |
| Bond number | 29 |
| Ring number | 2 |
| Rotor number | 4 |
| Residues number | 0 |
| Canonical smiles | CCCC(=O)Oc1c[nH]c2c1c(Cl)c(Br)cc2 |
