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

Structure

InChI Key HYJQVXHUENYDAK-UHFFFAOYSA-N
Smiles CC(Cl)CCC(Cl)CCC(Cl)C(C)Cl
InChI
InChI=1S/C10H18Cl4/c1-7(11)3-4-9(13)5-6-10(14)8(2)12/h7-10H,3-6H2,1-2H3

Physicochemical Descriptors

Property Name Value
Molecular Formula C10H18Cl4
Molecular Weight 278.02
AlogP 5.02
Number of Rotational Bond 7.0
Heavy Atoms 14.0

Cross References

Resources Reference
NORMAN SUSDAT