Base information
| Cat. No. | |
| CAS No. | 85-54-1 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C14H8ClNO5 |
| Molecular Weight | 305.67 |
| Exact Mass | 305.009 |
| XLogP3 | 3.7006 |
| Mr | 77.1078 |
| PSA | 100.19 |
| Sequence | - |
| Atom number | 29 |
| Bond number | 30 |
| Ring number | 2 |
| Rotor number | 4 |
| Residues number | 0 |
| Canonical smiles | O=C(c1ccccc1C(=O)O)c1ccc(c(c1)[N+](=O)[O-])Cl |
