Keyword(s): Human Metabolites
Molecule Category Free-form
UNII XE64D7GD53
EPA CompTox DTXSID2066353

Structure

InChI Key CFPZDVAZISWERM-UHFFFAOYSA-N
Smiles Clc1ccc(Br)cc1Cl
InChI
InChI=1S/C6H3BrCl2/c7-4-1-2-5(8)6(9)3-4/h1-3H

Physicochemical Descriptors

Property Name Value
Molecular Formula C6H3Br1Cl2
Molecular Weight 223.88
AlogP 3.76
Heavy Atoms 9.0

Cross References

Resources Reference
CAS NUMBER 18282-59-2
NORMAN SUSDAT
FDA SRS XE64D7GD53
PubChem 29013
ChemSpider 13881395.0