Base information
| Cat. No. | |
| CAS No. | 28525-13-5 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C13H9NO2S |
| Molecular Weight | 243.281 |
| Exact Mass | 243.035 |
| XLogP3 | 3.47188 |
| Mr | 63.095 |
| PSA | 66.31 |
| Sequence | - |
| Atom number | 26 |
| Bond number | 27 |
| Ring number | 2 |
| Rotor number | 2 |
| Residues number | 0 |
| Canonical smiles | N#Cc1ccc(cc1)S(=O)(=O)c1ccccc1 |
