Base information
| Cat. No. | |
| CAS No. | 117449-75-9 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C7H6ClNO3 |
| Molecular Weight | 187.58 |
| Exact Mass | 187.004 |
| XLogP3 | 1.0349 |
| Mr | 43.998 |
| PSA | 70.16 |
| Sequence | - |
| Atom number | 18 |
| Bond number | 18 |
| Ring number | 1 |
| Rotor number | 1 |
| Residues number | 0 |
| Canonical smiles | OC(=O)c1cc(Cl)c([nH]c1=O)C |
