| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | 2PM5BC2ULM |
| EPA CompTox | DTXSID30205384 |
Structure
| InChI Key | LLVRMRMMZQPDAK-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C7H12 |
| Molecular Weight | 96.09 |
| AlogP | 2.2 |
| Number of Rotational Bond | 2.0 |
| Heavy Atoms | 7.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 5685-47-2 |
| NORMAN SUSDAT | |
| FDA SRS | 2PM5BC2ULM |
| PubChem | 111091 |
| ChemSpider | 99721.0 |
CONTENTS
