| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| EPA CompTox | DTXSID1067334 |
| InChI Key | IBHCNMJSVDRBSY-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C7H4Cl1N1O4S1 |
| Molecular Weight | 232.95 |
| AlogP | 1.46 |
| Hydrogen Bond Acceptor | 5.0 |
| Hydrogen Bond Donor | 1.0 |
| Number of Rotational Bond | 1.0 |
| Polar Surface Area | 80.4 |
| Heavy Atoms | 14.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 27685-90-1 |
| NORMAN SUSDAT | |
| PubChem | 119698 |
| ChemSpider | 106874.0 |