Chem
J-GLOBAL ID：200907065862778060   Nikkaji number：J1.140.530D

4′-[[2,5-Bis(dodecyloxy)-4-ethynylphenyl]ethynyl]-2,2′:6′,2′′-terpyridine

4′-[[2,5-ビス(ドデシルオキシ)-4-エチニルフェニル]エチニル]-2,2′:6′,2′′-テルピリジン
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： C49H63N3O2
Molecular formula furigana： C49-H63-N3-O2
Molecular weight： 726.062
InChI： InChI=1S/C49H63N3O2/c1-4-7-9-11-13-15-17-19-21-27-35-53-48-40-43(49(39-42(48)6-3)54-36-28-22-20-18-16-14-12-10-8-5-2)32-31-41-37-46(44-29-23-25-33-50-44)52-47(38-41)45-30-24-26-34-51-45/h3,23-26,29-30,33-34,37-40H,4-5,7-22,27-28,35-36H2,1-2H3
InChI key： ROYZBTVJCZVPBR-UHFFFAOYSA-N
SMILES： CCCCCCCCCCCCOc1cc(C#Cc2cc(nc(c2)c2ccccn2)c2ccccn2)c(OCCCCCCCCCCCC)cc1C#C
Systematic name  (4)：
  • 4′-[[2,5-ビス(ドデシルオキシ)-4-エチニルフェニル]エチニル]-2,2′:6′,2′′-テルピリジン
  • 1-[(2,2′:6′,2′′-テルピリジン-4′-イル)エチニル]-2,5-ビス(ドデシルオキシ)-4-エチニルベンゼン
  • 4-{2-[2,5-ビス(ドデシルオキシ)-4-エチニルフェニル]エチニル}-6-(ピリジン-2-イル)-2,2'-ビピリジン
  • 4-{2-[2,5-bis(dodecyloxy)-4-ethynylphenyl]ethynyl}-6-(pyridin-2-yl)-2,2'-bipyridine
Other name (2)：
  • 4′-[[2,5-Bis(dodecyloxy)-4-ethynylphenyl]ethynyl]-2,2′:6′,2′′-terpyridine
  • 1-[(2,2′:6′,2′′-Terpyridine-4′-yl)ethynyl]-2,5-bis(dodecyloxy)-4-ethynylbenzene
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