Chem
J-GLOBAL ID：200907099619575314   Nikkaji number：J217.070A

4-Nitrochalcone

4-ニトロカルコン
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： C15H11[N+]O2[O-]
Molecular formula furigana： C15-H11-N-O3
Molecular weight： 253.257
InChI： InChI=1S/C15H11NO3/c17-15(13-4-2-1-3-5-13)11-8-12-6-9-14(10-7-12)16(18)19/h1-11H
InChI key： WDZGGAFMGIOIQS-UHFFFAOYSA-N
SMILES： [O-][N+](=O)c1ccc(C=CC(=O)c2ccccc2)cc1
Systematic name  (9)：
  • 1-フェニル-3-(4-ニトロフェニル)-2-プロペン-1-オン
  • α-(p-ニトロベンジリデン)アセトフェノン
  • 3-(p-ニトロフェニル)-1-フェニル-2-プロペン-1-オン
  • 3-(4-ニトロフェニル)-1-フェニル-2-プロペン-1-オン
  • β-(4-ニトロフェニル)アクリロフェノン
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Other name (8)：
  • 4-Nitrochalcone
  • 4-ニトロカルコン
  • 3-(p-Nitrophenyl)-1-phenyl-2-propen-1-one
  • 3-(4-Nitrophenyl)-1-phenyl-2-propen-1-one
  • α-(p-Nitrobenzylidene)acetophenone
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CAS registry number： 1222-98-6
Regulation number (2)：
  • EINECS2149495
  • TSCA(1222-98-6)
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