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

Structure

InChI Key CFXJOMGPUADAJE-UHFFFAOYSA-N
Smiles CC1(C2CC(C1=C)C(C2)O)C
InChI
InChI=1S/C10H16O/c1-6-8-4-7(5-9(8)11)10(6,2)3/h7-9,11H,1,4-5H2,2-3H3

Physicochemical Descriptors

Property Name Value
Molecular Formula C10H16O1
Molecular Weight 152.12
AlogP 1.97
Hydrogen Bond Acceptor 1.0
Hydrogen Bond Donor 1.0
Polar Surface Area 20.23
Heavy Atoms 11.0

Cross References

Resources Reference
NORMAN SUSDAT
PubChem 526611
ChemSpider 459068.0