Chem
J-GLOBAL ID：200907028866895050   Nikkaji number：J1.952.745J

1-O,1′-O-[3-(4,4,5,5,6,6,6-Heptafluorohexyl)biphenyl-4,4′-diyl]bisglycerol

1-O,1′-O-[3-(4,4,5,5,6,6,6-ヘプタフルオロヘキシル)ビフェニル-4,4′-ジイル]ビスグリセロール
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： C24H27F7O6
Molecular formula furigana： C24-H27-F7-O6
Molecular weight： 544.463
InChI： InChI=1S/C24H27F7O6/c25-22(26,23(27,28)24(29,30)31)9-1-2-17-10-16(5-8-21(17)37-14-19(35)12-33)15-3-6-20(7-4-15)36-13-18(34)11-32/h3-8,10,18-19,32-35H,1-2,9,11-14H2
InChI key： WXIAOQPZHVPFCA-UHFFFAOYSA-N
SMILES： OCC(O)COc1ccc(cc1)c1ccc(OCC(O)CO)c(CCCC(F)(F)C(F)(F)C(F)(F)F)c1
Systematic name  (3)：
  • 1-O,1′-O-[3-(4,4,5,5,6,6,6-ヘプタフルオロヘキシル)ビフェニル-4,4′-ジイル]ビスグリセロール
  • 3-{[4'-(2,3-ジヒドロキシプロポキシ)-3'-(4,4,5,5,6,6,6-ヘプタフルオロヘキシル)-[1,1'-ビフェニル]-4-イル]オキシ}プロパン-1,2-ジオール
  • 3-{[4'-(2,3-dihydroxypropoxy)-3'-(4,4,5,5,6,6,6-heptafluorohexyl)-[1,1'-biphenyl]-4-yl]oxy}propane-1,2-diol
Other name (1)：
  • 1-O,1′-O-[3-(4,4,5,5,6,6,6-Heptafluorohexyl)biphenyl-4,4′-diyl]bisglycerol
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