Keyword(s): Human Metabolites
Molecule Category Free-form
UNII 4PD48UV2V4
EPA CompTox DTXSID30369814

Structure

InChI Key RKWWASUTWAFKHA-UHFFFAOYSA-N
Smiles Fc1cccc(Br)c1F
InChI
InChI=1S/C6H3BrF2/c7-4-2-1-3-5(8)6(4)9/h1-3H

Physicochemical Descriptors

Property Name Value
Molecular Formula C6H3Br1F2
Molecular Weight 191.94
AlogP 2.73
Heavy Atoms 9.0

Cross References

Resources Reference
CAS NUMBER 38573-88-5
NORMAN SUSDAT
FDA SRS 4PD48UV2V4