Keyword(s): Human Metabolites
Molecule Category Free-form
UNII MM5Y5C3KJY
EPA CompTox DTXSID50189596

Structure

InChI Key FUGDHQXYVPQGLJ-UHFFFAOYSA-N
Smiles O=C1CCCCCCCCCCCCC1
InChI
InChI=1S/C14H26O/c15-14-12-10-8-6-4-2-1-3-5-7-9-11-13-14/h1-13H2

Physicochemical Descriptors

Property Name Value
Molecular Formula C14H26O1
Molecular Weight 210.2
AlogP 4.64
Hydrogen Bond Acceptor 1.0
Polar Surface Area 17.07
Heavy Atoms 15.0

Cross References

Resources Reference
CAS NUMBER 3603-99-4
NORMAN SUSDAT
FDA SRS MM5Y5C3KJY
PubChem 77153
ChemSpider 69590.0