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

Structure

InChI Key OYZWBFKOVRRZED-UHFFFAOYSA-N
Smiles OC1CCCCCCCCCC2=C1OCCC2
InChI
InChI=1S/C15H26O2/c16-14-11-7-5-3-1-2-4-6-9-13-10-8-12-17-15(13)14/h14,16H,1-12H2

Physicochemical Descriptors

Property Name Value
Molecular Formula C15H26O2
Molecular Weight 238.19
AlogP 3.94
Hydrogen Bond Acceptor 2.0
Hydrogen Bond Donor 1.0
Polar Surface Area 29.46
Heavy Atoms 17.0

Cross References

Resources Reference
NORMAN SUSDAT