Chem
J-GLOBAL ID:200907049746701496   Nikkaji number:J2.720.814B

1,3,5-Tris[4-[(S)-4-tert-butyl-2-oxazoline-2-yl]phenyl]-2,4,6-tris(2-pyridyl)benzene

1,3,5-トリス[4-[(S)-4-tert-ブチル-2-オキサゾリン-2-イル]フェニル]-2,4,6-トリス(2-ピリジル)ベンゼン
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: C60H60N6O3
Molecular formula furigana: C60-H60-N6-O3
Molecular weight: 913.179
InChI: InChI=1S/C60H60N6O3/c1-58(2,3)46-34-67-55(64-46)40-25-19-37(20-26-40)49-52(43-16-10-13-31-61-43)50(38-21-27-41(28-22-38)56-65-47(35-68-56)59(4,5)6)54(45-18-12-15-33-63-45)51(53(49)44-17-11-14-32-62-44)39-23-29-42(30-24-39)57-66-48(36-69-57)60(7,8)9/h10-33,46-48H,34-36H2,1-9H3/t46-,47-,48-/m1/s1
InChI key: NEVXLVDTWDACRK-VJOZVQJDSA-N
SMILES: CC(C)(C)[C@H]1COC(=N1)c1ccc(cc1)c1c(c2ccccn2)c(c2ccc(cc2)C2=N[C@H](CO2)C(C)(C)C)c(c2ccccn2)c(c2ccc(cc2)C2=N[C@H](CO2)C(C)(C)C)c1c1ccccn1
Systematic name  (4):
  • 2,2′,2′′-[2,4,6-トリス(2-ピリジル)-1,3,5-ベンゼントリイルトリス(4,1-フェニレン)]トリス[(4S)-4-tert-ブチル-2-オキサゾリン]
  • 1,3,5-トリス[4-[(S)-4-tert-ブチル-2-オキサゾリン-2-イル]フェニル]-2,4,6-トリス(2-ピリジル)ベンゼン
  • 2-{4'-[(4S)-4-tert-ブチル-4,5-ジヒドロ-1,3-オキサゾール-2-イル]-3,5-ビス({4-[(4S)-4-tert-ブチル-4,5-ジヒドロ-1,3-オキサゾール-2-イル]フェニル})-2,6-ビス(ピリジン-2-イル)-[1,1'-ビフェニル]-4-イル}ピリジン
  • 2-{4'-[(4S)-4-tert-butyl-4,5-dihydro-1,3-oxazol-2-yl]-3,5-bis({4-[(4S)-4-tert-butyl-4,5-dihydro-1,3-oxazol-2-yl]phenyl})-2,6-bis(pyridin-2-yl)-[1,1'-biphenyl]-4-yl}pyridine
Other name (2):
  • 2,2′,2′′-[2,4,6-Tris(2-pyridyl)-1,3,5-benzenetriyltris(4,1-phenylene)]tris[(4S)-4-tert-butyl-2-oxazoline]
  • 1,3,5-Tris[4-[(S)-4-tert-butyl-2-oxazoline-2-yl]phenyl]-2,4,6-tris(2-pyridyl)benzene
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