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

Structure

InChI Key IKJAQRZWKCSNLT-UHFFFAOYSA-N
Smiles BrC1(Br)CCCC(Br)(Br)C1(Br)Br
InChI
InChI=1/C6H6Br6/c7-4(8)2-1-3-5(9,10)6(4,11)12/h1-3H2

Physicochemical Descriptors

Property Name Value
Molecular Formula C6H6Br6
Molecular Weight 551.56
AlogP 5.63
Heavy Atoms 12.0

Cross References

Resources Reference
CAS NUMBER 30105-41-0
NORMAN SUSDAT
PubChem 21389908