Base information
| Cat. No. | |
| CAS No. | 11140-85-5 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C6H9ClO5 |
| Molecular Weight | 196.586 |
| Exact Mass | 196.014 |
| XLogP3 | -0.4927 |
| Mr | 40.5134 |
| PSA | 86.99 |
| Sequence | - |
| Atom number | 21 |
| Bond number | 20 |
| Ring number | 1 |
| Rotor number | 1 |
| Residues number | 0 |
| Canonical smiles | OC(=O)[C@H]1OC=C[C@H]([C@@H]1O)O.Cl |
