Chem
J-GLOBAL ID：200907015065941128   Nikkaji number：J9.301G

BP-4,5-oxide

ベンゾ[a]ピレン4,5-オキシド
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/c1-2-6-13-12(4-1)10-16-18-14(13)9-8-11-5-3-7-15(17(11)18)19-20(16)21-19/h1-10,19-20H
InChI key： XGZQLNASOQVQTD-UHFFFAOYSA-N
SMILES： O1C2C1c1cc3ccccc3c3ccc4cccc2c4c13
Systematic name  (5)：
  • 4,5-ジヒドロ-4,5-エポキシベンゾ[a]ピレン
  • 3b,4a-ジヒドロベンゾ[1,2]ピレノ[4,5-b]オキシレン
  • 4,5-エポキシ-4,5-ジヒドロベンゾ[a]ピレン
  • 18-オキサヘキサシクロ[10.7.2.03,8.09,20.016,21.017,19]ヘンイコサ-1,3,5,7,9(20),10,12,14,16(21)-ノナエン
  • 18-oxahexacyclo[10.7.2.03,8.09,20.016,21.017,19]henicosa-1,3,5,7,9(20),10,12,14,16(21)-nonaene
Other name (8)：
  • ベンゾ[a]ピレン4,5-オキシド
  • ベンゾ[a]ピレン4,5-エポキシド
  • Benzo[a]pyrene 4,5-oxide
  • Benzo[a]pyrene 4,5-epoxide
  • 3b,4a-Dihydrobenzo[1,2]pyreno[4,5-b]oxirene
Show all
CAS registry number： 37574-47-3
Regulation number (1)：
  • DJ7900000
KEGG COMPOUND： C14851
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