| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
Structure
| InChI Key | ZAJNMXDBJKCCAT-YFKPBYRVSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C6H11Cl1O3 |
| Molecular Weight | 166.04 |
| AlogP | 0.54 |
| Hydrogen Bond Acceptor | 3.0 |
| Hydrogen Bond Donor | 1.0 |
| Number of Rotational Bond | 4.0 |
| Polar Surface Area | 46.53 |
| Heavy Atoms | 10.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 86728-85-0 |
| NORMAN SUSDAT |
CONTENTS
