| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | 0BWG1HX6CK |
| EPA CompTox | DTXSID9075329 |
Structure
| InChI Key | RAFFVQBMVYYTQS-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C7H3Cl3O2 |
| Molecular Weight | 223.92 |
| AlogP | 3.35 |
| Hydrogen Bond Acceptor | 1.0 |
| Hydrogen Bond Donor | 1.0 |
| Number of Rotational Bond | 1.0 |
| Polar Surface Area | 37.3 |
| Heavy Atoms | 12.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 50-43-1 |
| NORMAN SUSDAT | |
| FDA SRS | 0BWG1HX6CK |
| PubChem | 5764 |
| ChemSpider | 5561.0 |
CONTENTS
