Base information
| Cat. No. | |
| CAS No. | 1022524-08-8 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C8H9IN2O |
| Molecular Weight | 276.074 |
| Exact Mass | 275.976 |
| XLogP3 | 2.2943 |
| Mr | 55.0216 |
| PSA | 55.12 |
| Sequence | - |
| Atom number | 21 |
| Bond number | 21 |
| Ring number | 1 |
| Rotor number | 2 |
| Residues number | 0 |
| Canonical smiles | NNC(=O)c1ccc(c(c1)C)I |
