Base information
| Cat. No. | |
| CAS No. | 1072808-07-1 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C18H13BF9N3 |
| Molecular Weight | 453.113 |
| Exact Mass | 453.106 |
| XLogP3 | 4.8853 |
| Mr | 94.084 |
| PSA | 21.7 |
| Sequence | - |
| Atom number | 44 |
| Bond number | 46 |
| Ring number | 4 |
| Rotor number | 3 |
| Residues number | 0 |
| Canonical smiles | F[B-](F)(F)F.Fc1c([n+]2cn3c(n2)CC[C@@H]3Cc2ccccc2)c(F)c(c(c1F)F)F |
