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

Structure

InChI Key XXZAOMJCZBZKPV-QXFUBDJGSA-N
Smiles ClC1CC2CCC1(C)C2(C)C
InChI
InChI=1/C10H17Cl/c1-9(2)7-4-5-10(9,3)8(11)6-7/h7-8H,4-6H2,1-3H3

Physicochemical Descriptors

Property Name Value
Molecular Formula C10H17Cl
Molecular Weight 172.1
AlogP 3.44
Heavy Atoms 11.0

Cross References

Resources Reference
CAS NUMBER 464-41-5
NORMAN SUSDAT
PubChem 12300205