Base information
| Cat. No. | |
| CAS No. | 42228-92-2 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C5H7ClN2O3 |
| Molecular Weight | 178.574 |
| Exact Mass | 178.015 |
| XLogP3 | -0.1246 |
| Mr | 41.4062 |
| PSA | 84.91 |
| Sequence | - |
| Atom number | 18 |
| Bond number | 18 |
| Ring number | 1 |
| Rotor number | 2 |
| Residues number | 0 |
| Canonical smiles | NC(C(=O)O)C1CC(=NO1)Cl |