| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| EPA CompTox | DTXSID50946500 |
Structure
| InChI Key | HEQHSFOPJKRGFK-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C11H10ClN |
| Molecular Weight | 191.05 |
| AlogP | 3.19 |
| Hydrogen Bond Acceptor | 1.0 |
| Number of Rotational Bond | 2.0 |
| Polar Surface Area | 4.93 |
| Heavy Atoms | 13.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 23694-46-4 |
| NORMAN SUSDAT | |
| PubChem | 90240 |
CONTENTS
