Chem
J-GLOBAL ID：200907035733807928   Nikkaji number：J1.456.920K

4,4′-[Ethyne-1,2-diylbis[1,4-phenylene(ethyne-1,2-diyl)(1,4-phenylene)(ethyne-1,2-diyl)]]bis(benzenethiol)

4,4′-[エチン-1,2-ジイルビス[1,4-フェニレン(エチン-1,2-ジイル)(1,4-フェニレン)(エチン-1,2-ジイル)]]ビス(ベンゼンチオール)
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： C46H26S2
Molecular formula furigana： C46-H26-S2
Molecular weight： 642.830
InChI： InChI=1S/C46H26S2/c47-45-31-27-43(28-32-45)25-23-41-19-15-39(16-20-41)13-11-37-7-3-35(4-8-37)1-2-36-5-9-38(10-6-36)12-14-40-17-21-42(22-18-40)24-26-44-29-33-46(48)34-30-44/h3-10,15-22,27-34,47-48H
InChI key： GSKIKLURCNMDFW-UHFFFAOYSA-N
SMILES： Sc1ccc(cc1)C#Cc1ccc(cc1)C#Cc1ccc(cc1)C#Cc1ccc(cc1)C#Cc1ccc(cc1)C#Cc1ccc(S)cc1
Systematic name  (3)：
  • 4,4′-[エチン-1,2-ジイルビス[1,4-フェニレン(エチン-1,2-ジイル)(1,4-フェニレン)(エチン-1,2-ジイル)]]ビス(ベンゼンチオール)
  • 4-(2-{4-[2-(4-{2-[4-(2-{4-[2-(4-スルファニルフェニル)エチニル]フェニル}エチニル)フェニル]エチニル}フェニル)エチニル]フェニル}エチニル)ベンゼン-1-チオール
  • 4-(2-{4-[2-(4-{2-[4-(2-{4-[2-(4-sulfanylphenyl)ethynyl]phenyl}ethynyl)phenyl]ethynyl}phenyl)ethynyl]phenyl}ethynyl)benzene-1-thiol
Other name (1)：
  • 4,4′-[Ethyne-1,2-diylbis[1,4-phenylene(ethyne-1,2-diyl)(1,4-phenylene)(ethyne-1,2-diyl)]]bis(benzenethiol)
Thsaurus map：
Thesaurus Map

Return to Previous Page

TOP

BOTTOM