| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | 56EG3J96KQ |
| EPA CompTox | DTXSID90204136 |
Structure
| InChI Key | AHPSZWVDPABXPI-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C4H5Cl1O2 |
| Molecular Weight | 120.0 |
| AlogP | 0.38 |
| Hydrogen Bond Acceptor | 2.0 |
| Number of Rotational Bond | 2.0 |
| Polar Surface Area | 34.14 |
| Heavy Atoms | 7.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 5559-62-6 |
| NORMAN SUSDAT | |
| FDA SRS | 56EG3J96KQ |
| PubChem | 79680 |
| ChemSpider | 71980.0 |
CONTENTS
