Chem
J-GLOBAL ID：200907050695230254
Nikkaji number：J1.160.342D
2,2′-[Cyclohexane-1β,2α-diylbis(nitrilomethylidyne)]bis[4-(heptadecafluorooctyl)phenol]
2,2′-[シクロヘキサン-1β,2α-ジイルビス(ニトリロメチリジン)]ビス[4-(ヘプタデカフルオロオクチル)フェノール]
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
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
Molecular formula： C36H20F34N2O2
Molecular formula furigana： C36-H20-F34-N2-O2
Molecular weight： 1158.514
InChI：
InChI=1S/C36H20F34N2O2/c37-21(38,23(41,42)25(45,46)27(49,50)29(53,54)31(57,58)33(61,62)35(65,66)67)15-5-7-19(73)13(9-15)11-71-17-3-1-2-4-18(17)72-12-14-10-16(6-8-20(14)74)22(39,40)24(43,44)26(47,48)28(51,52)30(55,56)32(59,60)34(63,64)36(68,69)70/h5-12,17-18,73-74H,1-4H2/t17-,18-/m1/s1
InChI key：
UAQGIWWURROQJH-QZTJIDSGSA-N
SMILES：
Oc1ccc(cc1C=N[C@@H]1CCCC[C@H]1N=Cc1cc(ccc1O)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)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
Systematic name (3)：
- 2,2′-[シクロヘキサン-1β,2α-ジイルビス(ニトリロメチリジン)]ビス[4-(ヘプタデカフルオロオクチル)フェノール]
- 4-(1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-ヘプタデカフルオロオクチル)-2-({[(1R,2R)-2-({[5-(1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-ヘプタデカフルオロオクチル)-2-ヒドロキシフェニル]メチリデン}アミノ)シクロヘキシル]イミノ}メチル)フェノール
- 4-(1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-heptadecafluorooctyl)-2-({[(1R,2R)-2-({[5-(1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-heptadecafluorooctyl)-2-hydroxyphenyl]methylidene}amino)cyclohexyl]imino}methyl)phenol
- 2,2′-[Cyclohexane-1β,2α-diylbis(nitrilomethylidyne)]bis[4-(heptadecafluorooctyl)phenol]
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