Keyword(s): | Human Metabolites |
Molecule Category | Free-form |
EPA CompTox | DTXSID90886451 |
InChI Key | MHTUIBIYJWEQKA-UHFFFAOYSA-N | |
---|---|---|
Smiles | ||
InChI |
|
Property Name | Value | |
---|---|---|
Molecular Formula | C18H20O2 | |
Molecular Weight | 268.15 | |
AlogP | 3.79 | |
Hydrogen Bond Acceptor | 2.0 | |
Hydrogen Bond Donor | 0.0 | |
Number of Rotational Bond | 5.0 | |
Polar Surface Area | 21.76 | |
Molecular species | None | |
Aromatic Rings | 2.0 | |
Heavy Atoms | 20.0 |
Resources | Reference | |
---|---|---|
CAS NUMBER | 61578-04-9 | |
NORMAN SUSDAT | ||
PubChem | 62186 |