Base information
| Cat. No. | |
| CAS No. | 21645-26-1 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C8H16N2S |
| Molecular Weight | 172.291 |
| Exact Mass | 172.103 |
| XLogP3 | 1.7796 |
| Mr | 53.5847 |
| PSA | 47.36 |
| Sequence | - |
| Atom number | 27 |
| Bond number | 26 |
| Ring number | 0 |
| Rotor number | 6 |
| Residues number | 0 |
| Canonical smiles | CCN(C(=S)NCC=C)CC |
