Base information
| Cat. No. | |
| CAS No. | 7499-96-9 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C11H13NO3S |
| Molecular Weight | 239.291 |
| Exact Mass | 239.062 |
| XLogP3 | 2.6499 |
| Mr | 64.0415 |
| PSA | 62.83 |
| Sequence | - |
| Atom number | 29 |
| Bond number | 30 |
| Ring number | 2 |
| Rotor number | 3 |
| Residues number | 0 |
| Canonical smiles | CCCCN1C(=O)c2c(S1(=O)=O)cccc2 |
