Base information
| Cat. No. | |
| CAS No. | 61934-55-2 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C5H5BrO2 |
| Molecular Weight | 176.996 |
| Exact Mass | 175.947 |
| XLogP3 | 0.8645 |
| Mr | 32.716 |
| PSA | 26.3 |
| Sequence | - |
| Atom number | 13 |
| Bond number | 13 |
| Ring number | 1 |
| Rotor number | 1 |
| Residues number | 0 |
| Canonical smiles | BrCC1=CC(=O)OC1 |
