Chem
J-GLOBAL ID:201607015892878296   Nikkaji number:J3.481.659J

2,2′-Bis[5,6-bis(4-dodecylphenyl)-1,1′:4′,1′′-terbenzene-2′-yl]-4,4′-dibromobiphenyl

2,2′-ビス[5,6-ビス(4-ドデシルフェニル)-1,1′:4′,1′′-テルベンゼン-2′-イル]-4,4′-ジブロモビフェニル
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: C120H144Br2
Molecular formula furigana: C120-H144-BR2
Molecular weight: 1746.280
InChI: InChI=1S/C120H144Br2/c1-5-9-13-17-21-25-29-33-37-43-53-93-65-73-99(74-66-93)107-61-51-63-113(119(107)101-77-69-95(70-78-101)55-45-39-35-31-27-23-19-15-11-7-3)111-85-81-103(97-57-47-41-48-58-97)89-115(111)117-91-105(121)83-87-109(117)110-88-84-106(122)92-118(110)116-90-104(98-59-49-42-50-60-98)82-86-112(116)114-64-52-62-108(100-75-67-94(68-76-100)54-44-38-34-30-26-22-18-14-10-6-2)120(114)102-79-71-96(72-80-102)56-46-40-36-32-28-24-20-16-12-8-4/h41-42,47-52,57-92H,5-40,43-46,53-56H2,1-4H3
InChI key: OHFMPYFSKHTNFR-UHFFFAOYSA-N
SMILES: CCCCCCCCCCCCc1ccc(cc1)c1cccc(c2ccc(cc2c2cc(Br)ccc2c2ccc(Br)cc2c2cc(ccc2c2cccc(c3ccc(CCCCCCCCCCCC)cc3)c2c2ccc(CCCCCCCCCCCC)cc2)c2ccccc2)c2ccccc2)c1c1ccc(CCCCCCCCCCCC)cc1
Systematic name  (3):
  • 2,2′-ビス[5,6-ビス(4-ドデシルフェニル)-1,1′:4′,1′′-テルベンゼン-2′-イル]-4,4′-ジブロモビフェニル
  • 4,4'-ジブロモ-2,2'-ビス({4-[4'-ドデシル-6-(4-ドデシルフェニル)-[1,1'-ビフェニル]-2-イル]-[1,1'-ビフェニル]-3-イル})-1,1'-ビフェニル
  • 4,4'-dibromo-2,2'-bis({4-[4'-dodecyl-6-(4-dodecylphenyl)-[1,1'-biphenyl]-2-yl]-[1,1'-biphenyl]-3-yl})-1,1'-biphenyl
Other name (1):
  • 2,2′-Bis[5,6-bis(4-dodecylphenyl)-1,1′:4′,1′′-terbenzene-2′-yl]-4,4′-dibromobiphenyl
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