Base information
| Cat. No. | |
| CAS No. | 389-58-2 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C9H6S2 |
| Molecular Weight | 178.274 |
| Exact Mass | 177.991 |
| XLogP3 | 3.3808 |
| Mr | 50.643 |
| PSA | 56.48 |
| Sequence | - |
| Atom number | 17 |
| Bond number | 19 |
| Ring number | 3 |
| Rotor number | 0 |
| Residues number | 0 |
| Canonical smiles | c1cc2c(-c3c(C2)ccs3)s1 |
