Base information
| Cat. No. | |
| CAS No. | 40106-16-9 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C13H19NO2S |
| Molecular Weight | 253.36 |
| Exact Mass | 253.114 |
| XLogP3 | 3.7472 |
| Mr | 71.8559 |
| PSA | 80.56 |
| Sequence | - |
| Atom number | 36 |
| Bond number | 37 |
| Ring number | 2 |
| Rotor number | 3 |
| Residues number | 0 |
| Canonical smiles | CCOC(=O)c1c(N)sc2c1CCCCCC2 |
