Base information
| Cat. No. | |
| CAS No. | 71095-42-6 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C9H8ClN |
| Molecular Weight | 165.62 |
| Exact Mass | 165.035 |
| XLogP3 | 3.1297 |
| Mr | 48.2747 |
| PSA | 15.79 |
| Sequence | - |
| Atom number | 19 |
| Bond number | 20 |
| Ring number | 2 |
| Rotor number | 0 |
| Residues number | 0 |
| Canonical smiles | Clc1ccc2c(c1)c(C)c[nH]2 |
