| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | K5R9AE3HNK |
| EPA CompTox | DTXSID10173057 |
Structure
| InChI Key | IMPIIVKYTNMBCD-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C13H10O2 |
| Molecular Weight | 198.07 |
| AlogP | 3.29 |
| Hydrogen Bond Acceptor | 2.0 |
| Number of Rotational Bond | 3.0 |
| Polar Surface Area | 26.3 |
| Heavy Atoms | 15.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 19434-34-5 |
| NORMAN SUSDAT | |
| FDA SRS | K5R9AE3HNK |
| PubChem | 88060 |
| ChemSpider | 79445.0 |
CONTENTS
