| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | BP3J7M3WWA |
| EPA CompTox | DTXSID5041481 |
Structure
| InChI Key | HJGHXDNIPAWLLE-OWOJBTEDSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C3H5Cl1O1 |
| Molecular Weight | 92.0 |
| AlogP | 0.73 |
| Hydrogen Bond Acceptor | 1.0 |
| Hydrogen Bond Donor | 1.0 |
| Number of Rotational Bond | 1.0 |
| Polar Surface Area | 20.23 |
| Heavy Atoms | 5.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 29560-84-7 |
| NORMAN SUSDAT | |
| FDA SRS | BP3J7M3WWA |
CONTENTS
