Base information
| Cat. No. | |
| CAS No. | 120069-21-8 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C5H9NO2S |
| Molecular Weight | 147.195 |
| Exact Mass | 147.035 |
| XLogP3 | 1.41398 |
| Mr | 34.862 |
| PSA | 66.31 |
| Sequence | - |
| Atom number | 18 |
| Bond number | 17 |
| Ring number | 0 |
| Rotor number | 2 |
| Residues number | 0 |
| Canonical smiles | CC(S(=O)(=O)CC#N)C |
