Keyword(s): | Human Metabolites |
Molecule Category | Free-form |
EPA CompTox | DTXSID8051964 |
InChI Key | AJVKAPQCJKEUSG-UHFFFAOYSA-N | |
---|---|---|
Smiles | ||
InChI |
|
Property Name | Value | |
---|---|---|
Molecular Formula | C11H20O1 | |
Molecular Weight | 168.15 | |
AlogP | 2.58 | |
Hydrogen Bond Acceptor | 1.0 | |
Hydrogen Bond Donor | 1.0 | |
Number of Rotational Bond | 0.0 | |
Polar Surface Area | 20.23 | |
Molecular species | None | |
Aromatic Rings | 0.0 | |
Heavy Atoms | 12.0 |
Resources | Reference | |
---|---|---|
CAS NUMBER | 28462-85-3 | |
NORMAN SUSDAT | ||
PubChem | 12648890 | |
ChemSpider | 19979800.0 |