Keyword(s): | Human Metabolites |
Molecule Category | Free-form |
UNII | E76192MWPA |
EPA CompTox | DTXSID5027934 |
InChI Key | PARGHORKDQHVPM-UHFFFAOYSA-N | |
---|---|---|
Smiles | ||
InChI |
|
Property Name | Value | |
---|---|---|
Molecular Formula | C15H16O | |
Molecular Weight | 212.12 | |
AlogP | 3.72 | |
Hydrogen Bond Acceptor | 1.0 | |
Hydrogen Bond Donor | 1.0 | |
Number of Rotational Bond | 2.0 | |
Polar Surface Area | 20.23 | |
Molecular species | None | |
Aromatic Rings | 2.0 | |
Heavy Atoms | 16.0 |
Resources | Reference | |
---|---|---|
CAS NUMBER | 27576-86-9 | |
NORMAN SUSDAT | ||
FDA SRS | E76192MWPA | |
PubChem | 33938 |