Hexabromobenzene
Synonyms: Hexabromobenzene, "Perbromobenzene", "1,2,3,4,5,6-Hexabromobenzene", "HXBBZ", "HexaBioomobenzene".
Source: Hexabromobenzene?is?used as fire retardant
Identifiers:
IUPAC Name: 1,2,3,4,5,6-hexabromobenzene
CAS Number: 87-82-1
PubChem ID: 6905
InChiKey: CAYGQBVSOZLICD-UHFFFAOYSA-N
Canonical SMILES: C1(=C(C(=C(C(=C1Br)Br)Br)Br)Br)Br
Structural Properties:
Molecular Formula: C6Br6
Molecular Weight: 551.5
Pharmacophore Features:
Number of bond donors: 0
Number of bond acceptors: 0
Number of atoms different from hydrogen: 12
Downloads
2D structure (.sdf)
3D structure (.sdf)
3D structure (.mol2)
3D structure (.pdb)
3D structure (.pdbqt)
Search Similar molecules
Evidence Supporting This Chemical as an Emerging Contaminant

Bichon, E., Guiffard, I., V?nisseau, A., Lesquin, E., Vaccher, V., Brosseaud, A., Marchand, P.,& Le BizecLABoratoire, B.(2016). Simultaneous determination of 16 brominated flame retardants infood and feed of animal origin by fast gas chromatography coupled totandem mass spectrometry using atmospheric pressure chemicalionisation. Journal of Chromatography A, 1459, 120?128.
External Links

2D-structure

3D-structure
