| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| EPA CompTox | DTXSID50939598 |
Structure
| InChI Key | PDKPYZSLHWQFNU-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C7H11Cl3O4 |
| Molecular Weight | 263.97 |
| AlogP | 2.89 |
| Hydrogen Bond Acceptor | 4.0 |
| Number of Rotational Bond | 4.0 |
| Polar Surface Area | 44.76 |
| Heavy Atoms | 14.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 18261-27-3 |
| NORMAN SUSDAT | |
| PubChem | 86690 |
CONTENTS
