| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | NX93J5ZDB7 |
| EPA CompTox | DTXSID00177246 |
Structure
| InChI Key | QDCKVAZDINMMHO-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C14H9Cl1O2 |
| Molecular Weight | 244.03 |
| AlogP | 3.41 |
| Hydrogen Bond Acceptor | 2.0 |
| Number of Rotational Bond | 3.0 |
| Polar Surface Area | 34.14 |
| Heavy Atoms | 17.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 22711-23-5 |
| NORMAN SUSDAT | |
| FDA SRS | NX93J5ZDB7 |
| PubChem | 89801 |
| ChemSpider | 81055.0 |
CONTENTS
