| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | R1RH0VBD2L |
| EPA CompTox | DTXSID0049319 |
Structure
| InChI Key | AEXMKKGTQYQZCS-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C7H16 |
| Molecular Weight | 100.13 |
| AlogP | 2.83 |
| Number of Rotational Bond | 2.0 |
| Heavy Atoms | 7.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 562-49-2 |
| NORMAN SUSDAT | |
| FDA SRS | R1RH0VBD2L |
| PubChem | 11229 |
| ChemSpider | 10755.0 |
CONTENTS
