| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | 36W53O7109 |
| EPA CompTox | DTXSID4021717 |
Structure
| InChI Key | AUESJGZPPPVYJZ-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C7H7Cl1O1 |
| Molecular Weight | 142.02 |
| AlogP | 2.13 |
| Hydrogen Bond Acceptor | 1.0 |
| Hydrogen Bond Donor | 1.0 |
| Number of Rotational Bond | 1.0 |
| Polar Surface Area | 20.23 |
| Heavy Atoms | 9.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 59-50-7 |
| NORMAN SUSDAT | |
| FDA SRS | 36W53O7109 |
CONTENTS
