Base information
| Cat. No. | |
| CAS No. | 51583-69-8 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C13H15NO3S |
| Molecular Weight | 265.328 |
| Exact Mass | 265.077 |
| XLogP3 | 2.4518 |
| Mr | 70.8034 |
| PSA | 69.46 |
| Sequence | - |
| Atom number | 33 |
| Bond number | 34 |
| Ring number | 2 |
| Rotor number | 4 |
| Residues number | 0 |
| Canonical smiles | Cc1ccc2c([n+]1CCCS(=O)(=O)[O-])cccc2 |