Chem
J-GLOBAL ID：200907074875903504   Nikkaji number：J36.047C

6-Bromobenzo[a]pyrene

6-ブロモベンゾ[a]ピレン
Substance type：
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula： C20H11Br
Molecular formula furigana： C20-H11-BR
Molecular weight： 331.212
InChI： InChI=1S/C20H11Br/c21-20-16-7-2-1-6-14(16)15-10-8-12-4-3-5-13-9-11-17(20)19(15)18(12)13/h1-11H
InChI key： MJSYSGSEEADMTK-UHFFFAOYSA-N
SMILES： Brc1c2ccccc2c2ccc3cccc4ccc1c2c34
Systematic name  (3)：
  • 6-ブロモベンゾ[a]ピレン
  • 8-ブロモペンタシクロ[10.6.2.02,7.09,19.016,20]イコサ-1(18),2,4,6,8,10,12,14,16,19-デカエン
  • 8-bromopentacyclo[10.6.2.02,7.09,19.016,20]icosa-1(18),2,4,6,8,10,12,14,16,19-decaene
Other name (1)：
  • 6-Bromobenzo[a]pyrene
CAS registry number： 21248-00-0
Regulation number (1)：
  • DJ4830000
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