Base information
| Cat. No. | |
| CAS No. | 106904-09-0 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C9H9ClO4S |
| Molecular Weight | 248.683 |
| Exact Mass | 247.991 |
| XLogP3 | 2.8309 |
| Mr | 56.4713 |
| PSA | 79.82 |
| Sequence | - |
| Atom number | 24 |
| Bond number | 24 |
| Ring number | 1 |
| Rotor number | 2 |
| Residues number | 0 |
| Canonical smiles | OC(=O)c1ccc(c(c1Cl)C)S(=O)(=O)C |
