| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | ICS5PD3141 |
| EPA CompTox | DTXSID7021314 |
Structure
| InChI Key | UXOXUHMFQZEAFR-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C12H8Cl4N2 |
| Molecular Weight | 319.94 |
| AlogP | 5.13 |
| Hydrogen Bond Acceptor | 2.0 |
| Hydrogen Bond Donor | 2.0 |
| Number of Rotational Bond | 1.0 |
| Polar Surface Area | 52.04 |
| Heavy Atoms | 18.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 15721-02-5 |
| NORMAN SUSDAT | |
| FDA SRS | ICS5PD3141 |
| PubChem | 27465 |
| ChemSpider | 25559.0 |
CONTENTS
