Keyword(s): | Human Metabolites ; Drinking Water Chemicals |
Molecule Category | Free-form |
InChI Key | ROKSAUSPJGWCSM-UWVGGRQHSA-N | |
---|---|---|
Smiles | ||
InChI |
|
Property Name | Value | |
---|---|---|
Molecular Formula | C11H18O1 | |
Molecular Weight | 166.14 | |
AlogP | 2.36 | |
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 | 0.0 | |
Heavy Atoms | 12.0 |
Resources | Reference | |
---|---|---|
CAS NUMBER | 35836-73-8 | |
NORMAN SUSDAT | ||
PubChem | 1272250 | |
ChemSpider | 1068002.0 |