Base information
| Cat. No. | |
| CAS No. | 21285-46-1 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C4H6Br2O2 |
| Molecular Weight | 245.897 |
| Exact Mass | 243.873 |
| XLogP3 | 0.9724 |
| Mr | 38.9316 |
| PSA | 40.46 |
| Sequence | - |
| Atom number | 14 |
| Bond number | 13 |
| Ring number | 0 |
| Rotor number | 2 |
| Residues number | 0 |
| Canonical smiles | OC/C(=C(/CO)\Br)/Br |
