| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | ASI2RQ5WEI |
| EPA CompTox | DTXSID10180509 |
| InChI Key | KLYHSJRCIZOUHE-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C7H12 |
| Molecular Weight | 96.09 |
| AlogP | 2.2 |
| Number of Rotational Bond | 1.0 |
| Heavy Atoms | 7.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 2586-89-2 |
| NORMAN SUSDAT | |
| FDA SRS | ASI2RQ5WEI |
| PubChem | 75755 |
| ChemSpider | 68268.0 |