| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | 12UC21C7SN |
| EPA CompTox | DTXSID3061477 |
| InChI Key | LBNXAWYDQUGHGX-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C13H20 |
| Molecular Weight | 176.16 |
| AlogP | 4.2 |
| Number of Rotational Bond | 6.0 |
| Heavy Atoms | 13.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 1078-71-3 |
| NORMAN SUSDAT | |
| FDA SRS | 12UC21C7SN |
| PubChem | 14115 |
| ChemSpider | 13492.0 |