Chem
J-GLOBAL ID:200907046295871024   Nikkaji number:J1.576.579H

2,5-Bis[3,5-di(tert-butyl)benzyl]-3-phenyl-6-[2′,5′-dihexyl-4′-(4,4,5,5-tetramethyl-1,3,2-dioxaborolane-2-yl)-4-biphenylyl]-1,2,4,5-tetrahydropyrrolo[3,4-c]pyrrole-1,4-dione

2,5-ビス[3,5-ジ(tert-ブチル)ベンジル]-3-フェニル-6-[2′,5′-ジヘキシル-4′-(4,4,5,5-テトラメチル-1,3,2-ジオキサボロラン-2-イル)-4-ビフェニリル]-1,2,4,5-テトラヒドロピロロ[3,4-c]ピロール-1,4-ジオン
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: C72H95BN2O4
Molecular formula furigana: C72-H95-B-N2-O4
Molecular weight: 1063.370
InChI: InChI=1S/C72H95BN2O4/c1-19-21-23-26-32-53-43-60(73-78-71(15,16)72(17,18)79-73)54(33-27-24-22-20-2)42-59(53)50-34-36-52(37-35-50)64-62-61(65(76)75(64)47-49-40-57(69(9,10)11)45-58(41-49)70(12,13)14)63(51-30-28-25-29-31-51)74(66(62)77)46-48-38-55(67(3,4)5)44-56(39-48)68(6,7)8/h25,28-31,34-45H,19-24,26-27,32-33,46-47H2,1-18H3
InChI key: SENQIJKFORPTDW-UHFFFAOYSA-N
SMILES: CCCCCCc1cc(c(CCCCCC)cc1B1OC(C)(C)C(C)(C)O1)c1ccc(cc1)c1c2c(=O)n(Cc3cc(cc(c3)C(C)(C)C)C(C)(C)C)c(c2c(=O)n1Cc1cc(cc(c1)C(C)(C)C)C(C)(C)C)c1ccccc1
Systematic name  (3):
  • 2,5-ビス[3,5-ジ(tert-ブチル)ベンジル]-3-フェニル-6-[2′,5′-ジヘキシル-4′-(4,4,5,5-テトラメチル-1,3,2-ジオキサボロラン-2-イル)-4-ビフェニリル]-1,2,4,5-テトラヒドロピロロ[3,4-c]ピロール-1,4-ジオン
  • 2,5-ビス[(3,5-ジ-tert-ブチルフェニル)メチル]-3-[2',5'-ジヘキシル-4'-(4,4,5,5-テトラメチル-1,3,2-ジオキサボロラン-2-イル)-[1,1'-ビフェニル]-4-イル]-6-フェニル-1H,2H,4H,5H-ピロロ[3,4-c]ピロール-1,4-ジオン
  • 2,5-bis[(3,5-di-tert-butylphenyl)methyl]-3-[2',5'-dihexyl-4'-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-[1,1'-biphenyl]-4-yl]-6-phenyl-1H,2H,4H,5H-pyrrolo[3,4-c]pyrrole-1,4-dione
Other name (1):
  • 2,5-Bis[3,5-di(tert-butyl)benzyl]-3-phenyl-6-[2′,5′-dihexyl-4′-(4,4,5,5-tetramethyl-1,3,2-dioxaborolane-2-yl)-4-biphenylyl]-1,2,4,5-tetrahydropyrrolo[3,4-c]pyrrole-1,4-dione
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