Base information
| Cat. No. | |
| CAS No. | 46376-16-3 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C9H11NO4S |
| Molecular Weight | 229.253 |
| Exact Mass | 229.041 |
| XLogP3 | 1.4725 |
| Mr | 53.8178 |
| PSA | 83.06 |
| Sequence | - |
| Atom number | 26 |
| Bond number | 26 |
| Ring number | 1 |
| Rotor number | 4 |
| Residues number | 0 |
| Canonical smiles | CN(S(=O)(=O)c1ccccc1)CC(=O)O |
