Keyword(s): Human Metabolites
Molecule Category Free-form
UNII X82R7655J4
EPA CompTox DTXSID5042451

Structure

InChI Key WZXXZHONLFRKGG-UHFFFAOYSA-N
Smiles Clc1c(Cl)c(Cl)c(Cl)s1
InChI
InChI=1S/C4Cl4S/c5-1-2(6)4(8)9-3(1)7

Physicochemical Descriptors

Property Name Value
Molecular Formula C4Cl4S1
Molecular Weight 219.85
AlogP 4.36
Hydrogen Bond Acceptor 1.0
Heavy Atoms 9.0

Cross References

Resources Reference
CAS NUMBER 6012-97-1
NORMAN SUSDAT
FDA SRS X82R7655J4
PubChem 22344
ChemSpider 20971.0