| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | 9L0EXQ7125 |
| EPA CompTox | DTXSID9075117 |
Structure
| InChI Key | SGKGVABHDAQAJO-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C7H3I1N2O3 |
| Molecular Weight | 289.92 |
| AlogP | 1.78 |
| Hydrogen Bond Acceptor | 4.0 |
| Hydrogen Bond Donor | 1.0 |
| Number of Rotational Bond | 1.0 |
| Polar Surface Area | 87.16 |
| Heavy Atoms | 13.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 1689-89-0 |
| NORMAN SUSDAT | |
| FDA SRS | 9L0EXQ7125 |
| PubChem | 15532 |
| ChemSpider | 14776.0 |
CONTENTS
