Chem
J-GLOBAL ID：200907032970874339   Nikkaji number：J1.952.750F

3-(4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,11-Heptadecafluoroundecyl)-4,4′-bis(2,3-dihydroxypropoxy)biphenyl

3-(4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,11-ヘプタデカフルオロウンデシル)-4,4′-ビス(2,3-ジヒドロキシプロポキシ)ビフェニル
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： C29H27F17O6
Molecular formula furigana： C29-H27-F17-O6
Molecular weight： 794.502
InChI： InChI=1S/C29H27F17O6/c30-22(31,23(32,33)24(34,35)25(36,37)26(38,39)27(40,41)28(42,43)29(44,45)46)9-1-2-17-10-16(5-8-21(17)52-14-19(50)12-48)15-3-6-20(7-4-15)51-13-18(49)11-47/h3-8,10,18-19,47-50H,1-2,9,11-14H2
InChI key： LTWHWEUTOMRWEI-UHFFFAOYSA-N
SMILES： OCC(O)COc1ccc(cc1)c1ccc(OCC(O)CO)c(CCCC(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  (4)：
  • 1-O,1′-O-[3-(4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,11-ヘプタデカフルオロウンデシル)ビフェニル-4,4′-ジイル]ビスグリセロール
  • 3-(4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,11-ヘプタデカフルオロウンデシル)-4,4′-ビス(2,3-ジヒドロキシプロポキシ)ビフェニル
  • 3-{[4'-(2,3-ジヒドロキシプロポキシ)-3'-(4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,11-ヘプタデカフルオロウンデシル)-[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'-(4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,11-heptadecafluoroundecyl)-[1,1'-biphenyl]-4-yl]oxy}propane-1,2-diol
Other name (2)：
  • 1-O,1′-O-[3-(4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,11-Heptadecafluoroundecyl)biphenyl-4,4′-diyl]bisglycerol
  • 3-(4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,11-Heptadecafluoroundecyl)-4,4′-bis(2,3-dihydroxypropoxy)biphenyl
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