Base information
| Cat. No. | |
| CAS No. | 1337745-23-9 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C9H9BrFN |
| Molecular Weight | 230.077 |
| Exact Mass | 228.99 |
| XLogP3 | 3.2345 |
| Mr | 49.4324 |
| PSA | 26.02 |
| Sequence | - |
| Atom number | 21 |
| Bond number | 22 |
| Ring number | 2 |
| Rotor number | 0 |
| Residues number | 0 |
| Canonical smiles | Brc1cc(F)c2c(c1)CCC2N |
