Chem
J-GLOBAL ID：200907098278156761   Nikkaji number：J1.827.317I

1-O,1′-O-[3-[6-(Henicosafluorodecyl)hexyloxy]biphenyl-4,4′-diyl]bisglycerol

1-O,1′-O-[3-[6-(ヘニコサフルオロデシル)ヘキシルオキシ]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： C34H33F21O7
Molecular formula furigana： C34-H33-F21-O7
Molecular weight： 952.597
InChI： InChI=1S/C34H33F21O7/c35-25(36,26(37,38)27(39,40)28(41,42)29(43,44)30(45,46)31(47,48)32(49,50)33(51,52)34(53,54)55)11-3-1-2-4-12-60-24-13-19(7-10-23(24)62-17-21(59)15-57)18-5-8-22(9-6-18)61-16-20(58)14-56/h5-10,13,20-21,56-59H,1-4,11-12,14-17H2
InChI key： LUNIMSAFSPKZKD-UHFFFAOYSA-N
SMILES： OCC(O)COc1ccc(cc1)c1ccc(OCC(O)CO)c(OCCCCCCC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F)c1
Systematic name  (3)：
  • 1-O,1′-O-[3-[6-(ヘニコサフルオロデシル)ヘキシルオキシ]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'-[(7,7,8,8,9,9,10,10,11,11,12,12,13,13,14,14,15,15,16,16,16-ヘンイコサフルオロヘキサデシル)オキシ]-[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'-[(7,7,8,8,9,9,10,10,11,11,12,12,13,13,14,14,15,15,16,16,16-henicosafluorohexadecyl)oxy]-[1,1'-biphenyl]-4-yl]oxy}propane-1,2-diol
Other name (1)：
  • 1-O,1′-O-[3-[6-(Henicosafluorodecyl)hexyloxy]biphenyl-4,4′-diyl]bisglycerol
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