Keyword(s): Human Metabolites
Molecule Category Free-form
UNII 8LZM666D8H
EPA CompTox DTXSID2059805

Structure

InChI Key XFAFBKQDEPXWCS-UHFFFAOYSA-N
Smiles FC=1C=CC=CC1C(Cl)Cl
InChI
InChI=1/C7H5Cl2F/c8-7(9)5-3-1-2-4-6(5)10/h1-4,7H

Physicochemical Descriptors

Property Name Value
Molecular Formula C7H5Cl2F
Molecular Weight 177.98
AlogP 3.3
Number of Rotational Bond 1.0
Heavy Atoms 10.0

Cross References

Resources Reference
CAS NUMBER 320-65-0
NORMAN SUSDAT
FDA SRS 8LZM666D8H
PubChem 67575