Base information
| Cat. No. | |
| CAS No. | 81108-81-8 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C8H3ClF3NO3 |
| Molecular Weight | 253.563 |
| Exact Mass | 252.975 |
| XLogP3 | 3.5158 |
| Mr | 50.4495 |
| PSA | 62.89 |
| Sequence | - |
| Atom number | 19 |
| Bond number | 19 |
| Ring number | 1 |
| Rotor number | 3 |
| Residues number | 0 |
| Canonical smiles | [O-][N+](=O)c1cc(ccc1C(=O)Cl)C(F)(F)F |
