| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | 1Z11279H67 |
| EPA CompTox | DTXSID8074992 |
Structure
| InChI Key | DNKPFCQEGBJJTE-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C3H6I2O1 |
| Molecular Weight | 311.85 |
| AlogP | 1.22 |
| Hydrogen Bond Acceptor | 1.0 |
| Hydrogen Bond Donor | 1.0 |
| Number of Rotational Bond | 2.0 |
| Polar Surface Area | 20.23 |
| Heavy Atoms | 6.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 534-08-7 |
| NORMAN SUSDAT | |
| FDA SRS | 1Z11279H67 |
| PubChem | 68295 |
| ChemSpider | 61592.0 |
CONTENTS
