Chem
J-GLOBAL ID:200907006799978995
Nikkaji number:J2.612.461A
2-Ethynyl-6-[[4-(octyloxy)-6-[[4-(octyloxy)-6-[[4-(octyloxy)-6-(1-dodecynyl)-2-pyridyl]ethynyl]-2-pyridyl]ethynyl]-2-pyridyl]ethynyl]pyridine
2-エチニル-6-[[4-(オクチルオキシ)-6-[[4-(オクチルオキシ)-6-[[4-(オクチルオキシ)-6-(1-ドデシニル)-2-ピリジル]エチニル]-2-ピリジル]エチニル]-2-ピリジル]エチニル]ピリジン
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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:
C64 H82 N4 O3
Molecular formula furigana:
C64-H82-N4-O3
Molecular weight:
955.385
InChI:
InChI=1S/C64H82N4O3/c1-6-11-15-19-23-24-25-26-27-31-36-56-48-62(69-45-32-28-20-16-12-7-2)50-58(66-56)41-42-60-52-64(71-47-34-30-22-18-14-9-4)53-61(68-60)44-43-59-51-63(70-46-33-29-21-17-13-8-3)49-57(67-59)40-39-55-38-35-37-54(10-5)65-55/h5,35,37-38,48-53H,6-9,11-30,32-34,45-47H2,1-4H3
InChI key:
XVSYVOCFDLDVKG-UHFFFAOYSA-N
SMILES:
CCCCCCCCCCC#Cc1cc(OCCCCCCCC)cc(n1)C#Cc1cc(OCCCCCCCC)cc(n1)C#Cc1cc(OCCCCCCCC)cc(n1)C#Cc1cccc(n1)C#C
Systematic name (3):
2-エチニル-6-[[4-(オクチルオキシ)-6-[[4-(オクチルオキシ)-6-[[4-(オクチルオキシ)-6-(1-ドデシニル)-2-ピリジル]エチニル]-2-ピリジル]エチニル]-2-ピリジル]エチニル]ピリジン
2-(ドデカ-1-イン-1-イル)-6-{2-[6-(2-{6-[2-(6-エチニルピリジン-2-イル)エチニル]-4-(オクチルオキシ)ピリジン-2-イル}エチニル)-4-(オクチルオキシ)ピリジン-2-イル]エチニル}-4-(オクチルオキシ)ピリジン
2-(dodec-1-yn-1-yl)-6-{2-[6-(2-{6-[2-(6-ethynylpyridin-2-yl)ethynyl]-4-(octyloxy)pyridin-2-yl}ethynyl)-4-(octyloxy)pyridin-2-yl]ethynyl}-4-(octyloxy)pyridine
Other name (1):
2-Ethynyl-6-[[4-(octyloxy)-6-[[4-(octyloxy)-6-[[4-(octyloxy)-6-(1-dodecynyl)-2-pyridyl]ethynyl]-2-pyridyl]ethynyl]-2-pyridyl]ethynyl]pyridine
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