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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