Base information
| Cat. No. | |
| CAS No. | 3356-94-3 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C7H8ClNO3 |
| Molecular Weight | 189.596 |
| Exact Mass | 189.019 |
| XLogP3 | 1.8131 |
| Mr | 42.5655 |
| PSA | 52.33 |
| Sequence | - |
| Atom number | 20 |
| Bond number | 20 |
| Ring number | 1 |
| Rotor number | 3 |
| Residues number | 0 |
| Canonical smiles | CCOC(=O)c1c(Cl)onc1C |
