| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | U7H8283W54 |
| EPA CompTox | DTXSID60164470 |
Structure
| InChI Key | JCAZSWWHFJVFPP-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C6H9Cl1O3 |
| Molecular Weight | 164.02 |
| AlogP | 1.1 |
| Hydrogen Bond Acceptor | 3.0 |
| Number of Rotational Bond | 4.0 |
| Polar Surface Area | 43.37 |
| Heavy Atoms | 10.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 1501-26-4 |
| NORMAN SUSDAT | |
| FDA SRS | U7H8283W54 |
| PubChem | 73916 |
| ChemSpider | 66549.0 |
CONTENTS
