Base information
| Cat. No. | |
| CAS No. | 27685-90-1 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C7H4ClNO4S |
| Molecular Weight | 233.629 |
| Exact Mass | 232.955 |
| XLogP3 | 2.1294 |
| Mr | 49.9177 |
| PSA | 88.52 |
| Sequence | - |
| Atom number | 18 |
| Bond number | 19 |
| Ring number | 2 |
| Rotor number | 1 |
| Residues number | 0 |
| Canonical smiles | O=c1[nH]c2c(o1)cc(cc2)S(=O)(=O)Cl |
