Chem
J-GLOBAL ID:200907025462665647   Nikkaji number:J2.229.563B

2,7-Dibromo-9,9-bis[4-[3,4-bis(2,5-dimethyl-3-thienyl)-3-cyclopentenyl]benzyl]-9H-fluorene

2,7-ジブロモ-9,9-ビス[4-[3,4-ビス(2,5-ジメチル-3-チエニル)-3-シクロペンテニル]ベンジル]-9H-フルオレン
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: C61H56Br2S4
Molecular formula furigana: C61-H56-BR2-S4
Molecular weight: 1077.170
InChI: InChI=1S/C61H56Br2S4/c1-33-21-51(37(5)64-33)55-25-45(26-56(55)52-22-34(2)65-38(52)6)43-13-9-41(10-14-43)31-61(59-29-47(62)17-19-49(59)50-20-18-48(63)30-60(50)61)32-42-11-15-44(16-12-42)46-27-57(53-23-35(3)66-39(53)7)58(28-46)54-24-36(4)67-40(54)8/h9-24,29-30,45-46H,25-28,31-32H2,1-8H3
InChI key: BCTHLYBSDDCNNM-UHFFFAOYSA-N
SMILES: Cc1cc(C2=C(CC(C2)c2ccc(CC3(Cc4ccc(cc4)C4CC(=C(C4)c4cc(C)sc4C)c4cc(C)sc4C)c4cc(Br)ccc4c4ccc(Br)cc34)cc2)c2cc(C)sc2C)c(C)s1
Systematic name  (3):
  • 2,7-ジブロモ-9,9-ビス[4-[3,4-ビス(2,5-ジメチル-3-チエニル)-3-シクロペンテニル]ベンジル]-9H-フルオレン
  • 3-[4-(4-{[9-({4-[3,4-ビス(2,5-ジメチルチオフェン-3-イル)シクロペンタ-3-エン-1-イル]フェニル}メチル)-2,7-ジブロモ-9H-フルオレン-9-イル]メチル}フェニル)-2-(2,5-ジメチルチオフェン-3-イル)シクロペンタ-1-エン-1-イル]-2,5-ジメチルチオフェン
  • 3-[4-(4-{[9-({4-[3,4-bis(2,5-dimethylthiophen-3-yl)cyclopent-3-en-1-yl]phenyl}methyl)-2,7-dibromo-9H-fluoren-9-yl]methyl}phenyl)-2-(2,5-dimethylthiophen-3-yl)cyclopent-1-en-1-yl]-2,5-dimethylthiophene
Other name (1):
  • 2,7-Dibromo-9,9-bis[4-[3,4-bis(2,5-dimethyl-3-thienyl)-3-cyclopentenyl]benzyl]-9H-fluorene
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