Keyword(s): Human Metabolites
Molecule Category Free-form
EPA CompTox DTXSID50148042

Structure

InChI Key BUYSIDPAOVWMQX-UHFFFAOYSA-N
Smiles FC=1C=C(Br)C(F)=C(F)C1F
InChI
InChI=1/C6HBrF4/c7-2-1-3(8)5(10)6(11)4(2)9/h1H

Physicochemical Descriptors

Property Name Value
Molecular Formula C6HBrF4
Molecular Weight 227.92
AlogP 3.01
Heavy Atoms 11.0

Cross References

Resources Reference
CAS NUMBER 1074-91-5
NORMAN SUSDAT
PubChem 66177