Chem
J-GLOBAL ID：200907038103692285   Nikkaji number：J1.952.754I

1-O,1′-O-[3-(4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,12,12,13,13,14,14,14-Tricosafluorotetradecyl)biphenyl-4,4′-diyl]bisglycerol

1-O,1′-O-[3-(4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,12,12,13,13,14,14,14-トリコサフルオロテトラデシル)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： C32H27F23O6
Molecular formula furigana： C32-H27-F23-O6
Molecular weight： 944.525
InChI： InChI=1S/C32H27F23O6/c33-22(34,9-1-2-17-10-16(5-8-21(17)61-14-19(59)12-57)15-3-6-20(7-4-15)60-13-18(58)11-56)23(35,36)24(37,38)25(39,40)26(41,42)27(43,44)28(45,46)29(47,48)30(49,50)31(51,52)32(53,54)55/h3-8,10,18-19,56-59H,1-2,9,11-14H2
InChI key： COUUYPQCVYQVOL-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)C(F)(F)C(F)(F)C(F)(F)F)c1
Systematic name  (3)：
  • 1-O,1′-O-[3-(4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,12,12,13,13,14,14,14-トリコサフルオロテトラデシル)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'-(4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,12,12,13,13,14,14,14-トリコサフルオロテトラデシル)-[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'-(4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,12,12,13,13,14,14,14-tricosafluorotetradecyl)-[1,1'-biphenyl]-4-yl]oxy}propane-1,2-diol
Other name (1)：
  • 1-O,1′-O-[3-(4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,12,12,13,13,14,14,14-Tricosafluorotetradecyl)biphenyl-4,4′-diyl]bisglycerol
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