Chem
J-GLOBAL ID：200907001407690067
Nikkaji number：J2.555.102H
4,4′,4′′-(Ethane-1,1,1-triyl)tris(methyleneoxy)tris[2,6-bis(2-pyridinyl)pyridine]
4,4′,4′′-(エタン-1,1,1-トリイル)トリス(メチレンオキシ)トリス[2,6-ビス(2-ピリジニル)ピリジン]
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
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
Molecular formula： C50H39N9O3
Molecular formula furigana： C50-H39-N9-O3
Molecular weight： 813.922
InChI：
InChI=1S/C50H39N9O3/c1-50(32-60-35-26-44(38-14-2-8-20-51-38)57-45(27-35)39-15-3-9-21-52-39,33-61-36-28-46(40-16-4-10-22-53-40)58-47(29-36)41-17-5-11-23-54-41)34-62-37-30-48(42-18-6-12-24-55-42)59-49(31-37)43-19-7-13-25-56-43/h2-31H,32-34H2,1H3
InChI key：
LQOSIFFQLSROID-UHFFFAOYSA-N
SMILES：
CC(COc1cc(nc(c1)c1ccccn1)c1ccccn1)(COc1cc(nc(c1)c1ccccn1)c1ccccn1)COc1cc(nc(c1)c1ccccn1)c1ccccn1
Systematic name (3)：
- 4,4′,4′′-(エタン-1,1,1-トリイル)トリス(メチレンオキシ)トリス[2,6-ビス(2-ピリジニル)ピリジン]
- 4-(2-メチル-3-{[6-(ピリジン-2-イル)-[2,2'-ビピリジン]-4-イル]オキシ}-2-({[6-(ピリジン-2-イル)-[2,2'-ビピリジン]-4-イル]オキシ}メチル)プロポキシ)-6-(ピリジン-2-イル)-2,2'-ビピリジン
- 4-(2-methyl-3-{[6-(pyridin-2-yl)-[2,2'-bipyridin]-4-yl]oxy}-2-({[6-(pyridin-2-yl)-[2,2'-bipyridin]-4-yl]oxy}methyl)propoxy)-6-(pyridin-2-yl)-2,2'-bipyridine
- 4,4′,4′′-(Ethane-1,1,1-triyl)tris(methyleneoxy)tris[2,6-bis(2-pyridinyl)pyridine]
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