| Keyword(s): | Human Metabolites |
| Molecule Category | Salt-form |
| EPA CompTox | DTXSID50234252 |
Structure
| InChI Key | PTMSYUSEEYPPMU-UHFFFAOYSA-M |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C9H13ClNO |
| Molecular Weight | 221.04 |
| AlogP | -1.77 |
| Hydrogen Bond Acceptor | 1.0 |
| Number of Rotational Bond | 5.0 |
| Polar Surface Area | 13.11 |
| Heavy Atoms | 13.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 85118-38-3 |
| NORMAN SUSDAT | |
| PubChem | 16205580 |
CONTENTS
