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

Structure

InChI Key JPQLLIUTUFJWMH-UHFFFAOYSA-N
Smiles Clc1cc(Cl)c2cc(Cl)c(Cl)c(Cl)c2c1Cl
InChI
InChI=1S/C10H2Cl6/c11-4-2-6(13)8(14)7-3(4)1-5(12)9(15)10(7)16/h1-2H

Physicochemical Descriptors

Property Name Value
Molecular Formula C10H2Cl6
Molecular Weight 331.83
AlogP 6.76
Heavy Atoms 16.0

Cross References

Resources Reference
CAS NUMBER 103426-94-4
NORMAN SUSDAT