Keyword(s): Human Metabolites
Molecule Category Free-form
UNII H58DI83RMD
EPA CompTox DTXSID3027241

Structure

InChI Key BASMANVIUSSIIM-UHFFFAOYSA-N
Smiles ClCc1ccccc1Cl
InChI
InChI=1S/C7H6Cl2/c8-5-6-3-1-2-4-7(6)9/h1-4H,5H2

Physicochemical Descriptors

Property Name Value
Molecular Formula C7H6Cl2
Molecular Weight 159.98
AlogP 3.08
Number of Rotational Bond 1.0
Heavy Atoms 9.0

Cross References

Resources Reference
CAS NUMBER 611-19-8
NORMAN SUSDAT
FDA SRS H58DI83RMD
PubChem 11906
ChemSpider 11412.0