| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | 49SE58CG6U |
| EPA CompTox | DTXSID60157882 |
Structure
| InChI Key | IOEDYYKJRCADRS-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C6H11Cl1O2 |
| Molecular Weight | 150.04 |
| AlogP | 1.38 |
| Hydrogen Bond Acceptor | 2.0 |
| Number of Rotational Bond | 2.0 |
| Polar Surface Area | 18.46 |
| Heavy Atoms | 9.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 13297-07-9 |
| NORMAN SUSDAT | |
| FDA SRS | 49SE58CG6U |
| PubChem | 83318 |
| ChemSpider | 75179.0 |
CONTENTS
