| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | NOT697X2XM |
| EPA CompTox | DTXSID10221128 |
Structure
| InChI Key | FXMKXMJLXRTQSW-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C6H3I1N2O4 |
| Molecular Weight | 293.91 |
| AlogP | 2.11 |
| Hydrogen Bond Acceptor | 4.0 |
| Number of Rotational Bond | 2.0 |
| Polar Surface Area | 86.28 |
| Heavy Atoms | 13.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 709-49-9 |
| NORMAN SUSDAT | |
| FDA SRS | NOT697X2XM |
| PubChem | 69730 |
| ChemSpider | 62930.0 |
CONTENTS
