2,3',4,4'5,5'-Hexabromobiphenyl


DEDuCT identifierDED000407
Pubchem identifier108023
CAS identifier67888-99-7
IUPAC name2,3',4,4'5,5'-Hexabromobiphenyl
Category based on type of supporting evidenceCategory III
Broad category based on environmental sourceIntermediates
Sub-category based on environmental sourceIndustrial Intermediates
Chemical kingdomOrganic compounds
Chemical super-classBenzenoids
Chemical classBenzene and substituted derivatives
SMILESC1=C(C=C(C(=C1Br)Br)Br)C2=CC(=C(C=C2Br)Br)Br
InChIInChI=1S/C12H4Br6/c13-7-4-9(15)8(14)3-6(7)5-1-10(16)12(18)11(17)2-5/h1-4H
InChIKeyGNBOTFDIPRGROV-UHFFFAOYSA-N

Download structure:
2D:2D MOL2D MOL22D SDF
3D:3D MOL3D MOL23D SDF3D PDB3D PDBQT

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