Chem
J-GLOBAL ID:200907026119287455   Nikkaji number:J1.528.363G

5,5′-[Ethyne-1,2-diylbis[m-phenylene(ethyne-1,2-diyl)]][3,3′-[ethyne-1,2-diylbis[m-phenylene(ethyne-1,2-diyl)]]dipyridine]

5,5′-[エチン-1,2-ジイルビス[m-フェニレン(エチン-1,2-ジイル)]][3,3′-[エチン-1,2-ジイルビス[m-フェニレン(エチン-1,2-ジイル)]]ジピリジン]
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: C46H22N2
Molecular formula furigana: C46-H22-N2
Molecular weight: 602.696
InChI: InChI=1S/C46H22N2/c1-5-35-13-14-36-6-2-10-40(26-36)18-23-45-30-46(34-48-33-45)24-20-42-12-4-8-38(28-42)16-15-37-7-3-11-41(27-37)19-22-44-29-43(31-47-32-44)21-17-39(9-1)25-35/h1-12,25-34H
InChI key: CWOZIJLGOVPRFY-UHFFFAOYSA-N
SMILES: c1cc2cc(c1)C#Cc1cncc(c1)C#Cc1cccc(c1)C#Cc1cccc(c1)C#Cc1cncc(c1)C#Cc1cccc(c1)C#C2
Systematic name  (3):
  • 5,5′-[エチン-1,2-ジイルビス[m-フェニレン(エチン-1,2-ジイル)]][3,3′-[エチン-1,2-ジイルビス[m-フェニレン(エチン-1,2-ジイル)]]ジピリジン]
  • 6,27-ジアザヘプタシクロ[37.3.1.14,8.111,15.118,22.125,29.132,36]オクタテトラコンタ-1(43),4,6,8(48),11,13,15(47),18(46),19,21,25,27,29(45),32,34,36(44),39,41-オクタデカエン-2,9,16,23,30,37-ヘキサイン
  • 6,27-diazaheptacyclo[37.3.1.14,8.111,15.118,22.125,29.132,36]octatetraconta-1(43),4,6,8(48),11,13,15(47),18(46),19,21,25,27,29(45),32,34,36(44),39,41-octadecaen-2,9,16,23,30,37-hexayne
Other name (1):
  • 5,5′-[Ethyne-1,2-diylbis[m-phenylene(ethyne-1,2-diyl)]][3,3′-[ethyne-1,2-diylbis[m-phenylene(ethyne-1,2-diyl)]]dipyridine]
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