Base information
| Cat. No. | |
| CAS No. | 50594-66-6 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C14H7ClF3NO5 |
| Molecular Weight | 361.657 |
| Exact Mass | 360.996 |
| XLogP3 | 5.2807 |
| Mr | 78.7513 |
| PSA | 92.35 |
| Sequence | - |
| Atom number | 31 |
| Bond number | 32 |
| Ring number | 2 |
| Rotor number | 5 |
| Residues number | 0 |
| Canonical smiles | Clc1cc(ccc1Oc1ccc(c(c1)C(=O)O)[N+](=O)[O-])C(F)(F)F |
