Base information
| Cat. No. | |
| CAS No. | 86-39-5 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C13H7ClOS |
| Molecular Weight | 246.712 |
| Exact Mass | 245.991 |
| XLogP3 | 4.0681 |
| Mr | 70.611 |
| PSA | 45.31 |
| Sequence | - |
| Atom number | 23 |
| Bond number | 25 |
| Ring number | 3 |
| Rotor number | 0 |
| Residues number | 0 |
| Canonical smiles | Clc1ccc2c(c1)c(=O)c1c(s2)cccc1 |
