| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | CIP6LXN5XW |
| EPA CompTox | DTXSID8042472 |
Structure
| InChI Key | IUXNWFUQIHHJRP-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C7H6O2S |
| Molecular Weight | 154.01 |
| AlogP | 1.46 |
| Hydrogen Bond Acceptor | 2.0 |
| Hydrogen Bond Donor | 2.0 |
| Number of Rotational Bond | 1.0 |
| Polar Surface Area | 37.3 |
| Heavy Atoms | 10.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 7283-41-2 |
| NORMAN SUSDAT | |
| FDA SRS | CIP6LXN5XW |
CONTENTS
