Chem
J-GLOBAL ID:201307039909562984   Nikkaji number:J3.209.212H

1,4-Bis(2-isocyanophenyl)butadiyne

1,4-ビス(2-イソシアノフェニル)ブタジイン
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: C16[C-]2H8[N+]2
Molecular formula furigana: C18-H8-N2
Molecular weight: 252.276
InChI: InChI=1S/C18H8N2/c1-19-17-13-7-5-11-15(17)9-3-4-10-16-12-6-8-14-18(16)20-2/h5-8,11-14H
InChI key: QXRSNWNEMZJCQC-UHFFFAOYSA-N
SMILES: [C-]#[N+]c1ccccc1C#CC#Cc1ccccc1[N+]#[C-]
Systematic name  (5):
  • 1,4-ビス(2-イソシアノフェニル)ブタジイン
  • 1,3-ブタジイン-1,4-ジイルビス(2,1-フェニレン)ジイソシアニド
  • [(1,3-ブタジイン-1,4-ジイル)ビス-o-フェニレン]ジイソシアニド
  • 1-イソシアノ-2-[4-(2-イソシアノフェニル)ブタ-1,3-ジイン-1-イル]ベンゼン
  • 1-isocyano-2-[4-(2-isocyanophenyl)buta-1,3-diyn-1-yl]benzene
Other name (3):
  • 1,4-Bis(2-isocyanophenyl)butadiyne
  • 1,3-Butadiyne-1,4-diylbis(2,1-phenylene)diisocyanide
  • [(1,3-Butadiyne-1,4-diyl)bis-o-phenylene]diisocyanide
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