| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | WTV4P2RB2J |
| EPA CompTox | DTXSID90231624 |
Structure
| InChI Key | RXCSODBXHNSSCQ-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C8H12 |
| Molecular Weight | 108.09 |
| AlogP | 2.36 |
| Number of Rotational Bond | 2.0 |
| Heavy Atoms | 8.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 822-93-5 |
| NORMAN SUSDAT | |
| FDA SRS | WTV4P2RB2J |
| PubChem | 69977 |
| ChemSpider | 63169.0 |
CONTENTS
