| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| EPA CompTox | DTXSID50181131 |
Structure
| InChI Key | MDDRQVPVBIQMQV-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C3H5Cl1O2S1 |
| Molecular Weight | 139.97 |
| AlogP | 2.03 |
| Hydrogen Bond Acceptor | 3.0 |
| Number of Rotational Bond | 1.0 |
| Polar Surface Area | 26.3 |
| Heavy Atoms | 7.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 26555-35-1 |
| NORMAN SUSDAT | |
| PubChem | 117817 |
| ChemSpider | 105284.0 |
CONTENTS
