| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | 7ZB9KVX88I |
| EPA CompTox | DTXSID80173165 |
| InChI Key | QXXSPCOLSLNNNE-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C8H5I2N1O5 |
| Molecular Weight | 448.83 |
| AlogP | 0.99 |
| Hydrogen Bond Acceptor | 4.0 |
| Hydrogen Bond Donor | 2.0 |
| Number of Rotational Bond | 2.0 |
| Polar Surface Area | 96.6 |
| Heavy Atoms | 16.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 1951-53-7 |
| NORMAN SUSDAT | |
| FDA SRS | 7ZB9KVX88I |
| PubChem | 68212 |
| ChemSpider | 61519.0 |