Keyword(s): Human Metabolites
Molecule Category Free-form

Structure

InChI Key NDZOISQLWLWLEW-UHFFFAOYSA-N
Smiles OC1CCCC2CCCCC12
InChI
InChI=1/C10H18O/c11-10-7-3-5-8-4-1-2-6-9(8)10/h8-11H,1-7H2

Physicochemical Descriptors

Property Name Value
Molecular Formula C10H18O
Molecular Weight 154.14
AlogP 2.34
Hydrogen Bond Acceptor 1.0
Hydrogen Bond Donor 1.0
Polar Surface Area 20.23
Heavy Atoms 11.0

Cross References

Resources Reference
CAS NUMBER 529-32-8
NORMAN SUSDAT
PubChem 102425