Base information
| Cat. No. | |
| CAS No. | 1214791-57-7 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C9H6BrFO2 |
| Molecular Weight | 245.045 |
| Exact Mass | 243.954 |
| XLogP3 | 2.686 |
| Mr | 50.7698 |
| PSA | 37.3 |
| Sequence | - |
| Atom number | 19 |
| Bond number | 19 |
| Ring number | 1 |
| Rotor number | 2 |
| Residues number | 0 |
| Canonical smiles | OC(=O)C=Cc1cccc(c1F)Br |
