Chem
J-GLOBAL ID：200907047507151309   Nikkaji number：J2.748K

Benzo(a)pyren-9-ol

ベンゾ[a]ピレン-9-オール
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： C20H12O
Molecular formula furigana： C20-H12-O
Molecular weight： 268.315
InChI： InChI=1S/C20H12O/c21-16-8-6-14-10-15-5-4-12-2-1-3-13-7-9-17(18(14)11-16)20(15)19(12)13/h1-11,21H
InChI key： OBBBXCAFTKLFGZ-UHFFFAOYSA-N
SMILES： Oc1ccc2cc3ccc4cccc5ccc(c2c1)c3c45
Systematic name  (4)：
  • 9-ヒドロキシベンゾ[a]ピレン
  • ベンゾ[a]ピレン-9-オール
  • 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-4-オール
  • pentacyclo[10.6.2.02,7.09,19.016,20]icosa-1(18),2,4,6,8,10,12,14,16,19-decaen-4-ol
Other name (3)：
  • Benzo[a]pyren-9-ol
  • 9-HOBP
  • 9-Hydroxybenzo[a]pyrene
CAS registry number： 17573-21-6
Regulation number (1)：
  • DJ8280000
KEGG COMPOUND： C14556
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