Base information
| Cat. No. | |
| CAS No. | 79614-91-8 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C14H7ClF6N4O5 |
| Molecular Weight | 460.673 |
| Exact Mass | 460.001 |
| XLogP3 | 6.4606 |
| Mr | 92.9307 |
| PSA | 125.79 |
| Sequence | - |
| Atom number | 37 |
| Bond number | 38 |
| Ring number | 2 |
| Rotor number | 7 |
| Residues number | 0 |
| Canonical smiles | COc1c([N+](=O)[O-])c(Nc2ncc(cc2Cl)C(F)(F)F)c(cc1C(F)(F)F)[N+](=O)[O-] |
