Base information
| Cat. No. | |
| CAS No. | 112440-49-0 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C9H11NS |
| Molecular Weight | 165.255 |
| Exact Mass | 165.061 |
| XLogP3 | 2.73938 |
| Mr | 48.739 |
| PSA | 52.03 |
| Sequence | - |
| Atom number | 22 |
| Bond number | 22 |
| Ring number | 1 |
| Rotor number | 1 |
| Residues number | 0 |
| Canonical smiles | N#CCc1c(C)sc(c1C)C |
