| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | CS4GYA9R3Z |
| EPA CompTox | DTXSID00334099 |
Structure
| InChI Key | GEBYSTBEDVQOTK-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C7H4Cl1I1O2 |
| Molecular Weight | 281.89 |
| AlogP | 2.64 |
| Hydrogen Bond Acceptor | 1.0 |
| Hydrogen Bond Donor | 1.0 |
| Number of Rotational Bond | 1.0 |
| Polar Surface Area | 37.3 |
| Heavy Atoms | 11.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 19094-56-5 |
| NORMAN SUSDAT | |
| FDA SRS | CS4GYA9R3Z |
| PubChem | 519638 |
| ChemSpider | 453265.0 |
CONTENTS
