Base information
| Cat. No. | |
| CAS No. | 18773-54-1 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C13H13NO2S |
| Molecular Weight | 247.313 |
| Exact Mass | 247.067 |
| XLogP3 | 2.3329 |
| Mr | 67.757 |
| PSA | 45.76 |
| Sequence | - |
| Atom number | 30 |
| Bond number | 30 |
| Ring number | 1 |
| Rotor number | 4 |
| Residues number | 0 |
| Canonical smiles | C#CCN(S(=O)(=O)c1ccc(cc1)C)CC#C |
