Keyword(s): Human Metabolites
Molecule Category Free-form
EPA CompTox DTXSID4061915

Structure

InChI Key MVOSYKNQRRHGKX-UHFFFAOYSA-N
Smiles O=C1CCCCCCCCCCO1
InChI
InChI=1S/C11H20O2/c12-11-9-7-5-3-1-2-4-6-8-10-13-11/h1-10H2

Physicochemical Descriptors

Property Name Value
Molecular Formula C11H20O2
Molecular Weight 184.15
AlogP 3.05
Hydrogen Bond Acceptor 2.0
Polar Surface Area 26.3
Heavy Atoms 13.0

Cross References

Resources Reference
CAS NUMBER 39282-36-5
NORMAN SUSDAT
PubChem 74409
ChemSpider 67001.0