Base information
| Cat. No. | |
| CAS No. | 171876-22-5 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C8H7ClN2O4 |
| Molecular Weight | 230.605 |
| Exact Mass | 230.009 |
| XLogP3 | 2.3431 |
| Mr | 54.1555 |
| PSA | 85.01 |
| Sequence | - |
| Atom number | 22 |
| Bond number | 22 |
| Ring number | 1 |
| Rotor number | 4 |
| Residues number | 0 |
| Canonical smiles | CCOC(=O)c1cnc(c(c1)[N+](=O)[O-])Cl |
