Chem
J-GLOBAL ID：200907087560113984   Nikkaji number：J1.430.495I

4,4′-[3,3,4,4,5,5-Hexafluoro-1-cyclopentene-2,1-diylbis(2-methylthiophene-5,3-diyl)]bis[N,N-bis(p-tolyl)aniline]

4,4′-[3,3,4,4,5,5-ヘキサフルオロ-1-シクロペンテン-2,1-ジイルビス(2-メチルチオフェン-5,3-ジイル)]ビス[N,N-ビス(p-トリル)アニリン]
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： C55H44F6N2S2
Molecular formula furigana： C55-H44-F6-N2-S2
Molecular weight： 911.080
InChI： InChI=1S/C55H44F6N2S2/c1-33-7-19-41(20-8-33)62(42-21-9-34(2)10-22-42)45-27-15-39(16-28-45)47-31-49(64-37(47)5)51-52(54(58,59)55(60,61)53(51,56)57)50-32-48(38(6)65-50)40-17-29-46(30-18-40)63(43-23-11-35(3)12-24-43)44-25-13-36(4)14-26-44/h7-32H,1-6H3
InChI key： AETXTLUFXCDUOX-UHFFFAOYSA-N
SMILES： Cc1sc(cc1c1ccc(cc1)N(c1ccc(C)cc1)c1ccc(C)cc1)C1=C(c2cc(c(C)s2)c2ccc(cc2)N(c2ccc(C)cc2)c2ccc(C)cc2)C(F)(F)C(F)(F)C1(F)F
Systematic name  (3)：
  • 4,4′-[3,3,4,4,5,5-ヘキサフルオロ-1-シクロペンテン-2,1-ジイルビス(2-メチルチオフェン-5,3-ジイル)]ビス[N,N-ビス(p-トリル)アニリン]
  • 4-{5-[2-(4-{4-[ビス(4-メチルフェニル)アミノ]フェニル}-5-メチルチオフェン-2-イル)-3,3,4,4,5,5-ヘキサフルオロシクロペンタ-1-エン-1-イル]-2-メチルチオフェン-3-イル}-N,N-ビス(4-メチルフェニル)アニリン
  • 4-{5-[2-(4-{4-[bis(4-methylphenyl)amino]phenyl}-5-methylthiophen-2-yl)-3,3,4,4,5,5-hexafluorocyclopent-1-en-1-yl]-2-methylthiophen-3-yl}-N,N-bis(4-methylphenyl)aniline
Other name (1)：
  • 4,4′-[3,3,4,4,5,5-Hexafluoro-1-cyclopentene-2,1-diylbis(2-methylthiophene-5,3-diyl)]bis[N,N-bis(p-tolyl)aniline]
Thsaurus map：
Thesaurus Map

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