Base information
| Cat. No. | |
| CAS No. | 31699-14-6 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C9H7IN2S |
| Molecular Weight | 302.135 |
| Exact Mass | 301.937 |
| XLogP3 | 3.5781 |
| Mr | 64.6714 |
| PSA | 67.15 |
| Sequence | - |
| Atom number | 20 |
| Bond number | 21 |
| Ring number | 2 |
| Rotor number | 1 |
| Residues number | 0 |
| Canonical smiles | Ic1ccc(cc1)c1csc(n1)N |
