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

Structure

InChI Key KUKRLSJNTMLPPK-UHFFFAOYSA-N
Smiles CC1(C)C2CCC1(C)C=C2
InChI
InChI=1S/C10H16/c1-9(2)8-4-6-10(9,3)7-5-8/h4,6,8H,5,7H2,1-3H3

Physicochemical Descriptors

Property Name Value
Molecular Formula C10H16
Molecular Weight 136.13
AlogP 3.0
Heavy Atoms 10.0

Cross References

Resources Reference
CAS NUMBER 464-17-5
NORMAN SUSDAT
PubChem 10047
ChemSpider 9652.0