Base information
| Cat. No. | |
| CAS No. | 85092-85-9 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C8H5ClIN |
| Molecular Weight | 277.489 |
| Exact Mass | 276.916 |
| XLogP3 | 3.4259 |
| Mr | 56.0257 |
| PSA | 15.79 |
| Sequence | - |
| Atom number | 16 |
| Bond number | 17 |
| Ring number | 2 |
| Rotor number | 0 |
| Residues number | 0 |
| Canonical smiles | Clc1ccc2c(c1)c(I)c[nH]2 |
