Chem
J-GLOBAL ID：201207040086216571   Nikkaji number：J3.001.956C

1-[(4-Chlorophenyl)ethynyl]-4-nitrobenzene

1-[(4-クロロフェニル)エチニル]-4-ニトロベンゼン
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： C14H8Cl[N+]O[O-]
Molecular formula furigana： C14-H8-CL-N-O2
Molecular weight： 257.670
InChI： InChI=1S/C14H8ClNO2/c15-13-7-3-11(4-8-13)1-2-12-5-9-14(10-6-12)16(17)18/h3-10H
InChI key： MWHMVTCMNDGOEO-UHFFFAOYSA-N
SMILES： [O-][N+](=O)c1ccc(cc1)C#Cc1ccc(Cl)cc1
Systematic name  (5)：
  • 1-[(4-クロロフェニル)エチニル]-4-ニトロベンゼン
  • 4-ニトロ-4′-クロロ-(1,1′-エチニレンビスベンゼン)
  • 1-(4-クロロフェニル)-2-(4-ニトロフェニル)アセチレン
  • 1-[2-(4-クロロフェニル)エチニル]-4-ニトロベンゼン
  • 1-[2-(4-chlorophenyl)ethynyl]-4-nitrobenzene
Other name (3)：
  • 1-[(4-Chlorophenyl)ethynyl]-4-nitrobenzene
  • 4-Nitro-4′-chloro-(1,1′-ethynylenebisbenzene)
  • 1-(4-Chlorophenyl)-2-(4-nitrophenyl)acetylene
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