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

Structure

InChI Key OUCSIUCEQVCDEL-UHFFFAOYSA-N
Smiles Oc1ccc(Br)c(Br)c1Br
InChI
InChI=1S/C6H3Br3O/c7-3-1-2-4(10)6(9)5(3)8/h1-2,10H

Physicochemical Descriptors

Property Name Value
Molecular Formula C6H3Br3O1
Molecular Weight 327.77
AlogP 3.68
Hydrogen Bond Acceptor 1.0
Hydrogen Bond Donor 1.0
Polar Surface Area 20.23
Heavy Atoms 10.0

Cross References

Resources Reference
CAS NUMBER 25376-38-9
NORMAN SUSDAT