Base information
| Cat. No. | |
| CAS No. | 40644-14-2 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C7H5IN2O |
| Molecular Weight | 260.032 |
| Exact Mass | 259.945 |
| XLogP3 | 1.4608 |
| Mr | 51.6364 |
| PSA | 48.65 |
| Sequence | - |
| Atom number | 16 |
| Bond number | 17 |
| Ring number | 2 |
| Rotor number | 0 |
| Residues number | 0 |
| Canonical smiles | Ic1ccc2c(c1)[nH]c(=O)[nH]2 |
