Base information
| Cat. No. | |
| CAS No. | 154561-38-3 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C12H11BrO3 |
| Molecular Weight | 283.118 |
| Exact Mass | 281.989 |
| XLogP3 | 2.3636 |
| Mr | 64.5455 |
| PSA | 43.37 |
| Sequence | - |
| Atom number | 27 |
| Bond number | 27 |
| Ring number | 1 |
| Rotor number | 6 |
| Residues number | 0 |
| Canonical smiles | BrCC=CC(=O)OCC(=O)c1ccccc1 |
