| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | 5R32RJ2V2A |
| EPA CompTox | DTXSID30146905 |
Structure
| InChI Key | JUBORNFANZZVJL-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C4H8Cl1N1O1 |
| Molecular Weight | 121.03 |
| AlogP | 1.2 |
| Hydrogen Bond Acceptor | 1.0 |
| Hydrogen Bond Donor | 1.0 |
| Number of Rotational Bond | 2.0 |
| Polar Surface Area | 32.59 |
| Heavy Atoms | 7.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 105-35-1 |
| NORMAN SUSDAT | |
| FDA SRS | 5R32RJ2V2A |
| PubChem | 66044 |
| ChemSpider | 59435.0 |
CONTENTS
