| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | RU6JX11G7W |
| EPA CompTox | DTXSID4024989 |
Structure
| InChI Key | IDJOCJAIQSKSOP-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C2H4Cl2O1 |
| Molecular Weight | 113.96 |
| AlogP | 0.78 |
| 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 | 598-38-9 |
| NORMAN SUSDAT | |
| FDA SRS | RU6JX11G7W |
| PubChem | 11718 |
| ChemSpider | 11226.0 |
CONTENTS
