Chem
J-GLOBAL ID：200907080545822010   Nikkaji number：J1.000.897B

1,1′-(Hexafluoroisopropylidene)bis[3,4-bis(phenylethynyl)benzene]

1,1′-ビス(トリフルオロメチル)メチレンビス[3,4-ビス(フェニルエチニル)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： C47H26F6
Molecular formula furigana： C47-H26-F6
Molecular weight： 704.715
InChI： InChI=1S/C47H26F6/c48-46(49,50)45(47(51,52)53,43-31-29-39(25-21-35-13-5-1-6-14-35)41(33-43)27-23-37-17-9-3-10-18-37)44-32-30-40(26-22-36-15-7-2-8-16-36)42(34-44)28-24-38-19-11-4-12-20-38/h1-20,29-34H
InChI key： PBLVCWAIYDFCGP-UHFFFAOYSA-N
SMILES： FC(F)(F)C(c1ccc(C#Cc2ccccc2)c(c1)C#Cc1ccccc1)(c1ccc(C#Cc2ccccc2)c(c1)C#Cc1ccccc1)C(F)(F)F
Systematic name  (8)：
  • 1,1,1,3,3,3-ヘキサフルオロ-2,2-ビス[3,4-ビス(フェニルエチニル)フェニル]プロパン
  • 1,1′-(ヘキサフルオロイソプロピリデン)ビス[3,4-ビス(フェニルエチニル)ベンゼン]
  • 4,4′-(1,1,1,3,3,3-ヘキサフルオロプロパン-2,2-ジイル)ビス[1,2-ビス(フェニルエチニル)ベンゼン]
  • 4,4′-(ヘキサフルオロイソプロピリデン)ビス[1,2-ビス(フェニルエチニル)ベンゼン]
  • 2,2-ビス[3,4-ビス(フェニルエチニル)フェニル]-1,1,1,3,3,3-ヘキサフルオロプロパン
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Other name (6)：
  • 1,1,1,3,3,3-Hexafluoro-2,2-bis[3,4-bis(phenylethynyl)phenyl]propane
  • 1,1′-(Hexafluoroisopropylidene)bis[3,4-bis(phenylethynyl)benzene]
  • 4,4′-(1,1,1,3,3,3-Hexafluoropropane-2,2-diyl)bis[1,2-bis(phenylethynyl)benzene]
  • 4,4′-(Hexafluoroisopropylidene)bis[1,2-bis(phenylethynyl)benzene]
  • 2,2-Bis[3,4-bis(phenylethynyl)phenyl]-1,1,1,3,3,3-hexafluoropropane
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