Keyword(s): Human Metabolites
Molecule Category Free-form
UNII UX2FDH9GLC
EPA CompTox DTXSID4063242

Structure

InChI Key UBJKMVAYDQUJSJ-UHFFFAOYSA-N
Smiles ClCc1cc(Cl)c(Cl)cc1Cl
InChI
InChI=1S/C7H4Cl4/c8-3-4-1-6(10)7(11)2-5(4)9/h1-2H,3H2

Physicochemical Descriptors

Property Name Value
Molecular Formula C7H4Cl4
Molecular Weight 227.91
AlogP 4.39
Number of Rotational Bond 1.0
Heavy Atoms 11.0

Cross References

Resources Reference
CAS NUMBER 3955-26-8
NORMAN SUSDAT
FDA SRS UX2FDH9GLC
PubChem 77559
ChemSpider 69965.0