Chem
J-GLOBAL ID:202007001974236421   Nikkaji number:J3.748.145I

1,3-bis({4-[tris(3,3,4,4,5,5,6,6,7,7,8,8,8-tridecafluorooctyl)silyl]phenyl}methyl)imidazol-1-ium

1,3-ビス({4-[トリス(3,3,4,4,5,5,6,6,7,7,8,8,8-トリデカフルオロオクチル)シリル]フェニル}メチル)イミダゾール-1-イウム
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: C65H39F78N2Si2
Molecular formula furigana: C65-H39-F78-N2-SI2
Molecular weight: 2386.086
InChI: InChI=1S/C65H39F78N2Si2/c66-30(67,36(78,79)42(90,91)48(102,103)54(114,115)60(126,127)128)9-17-146(18-10-31(68,69)37(80,81)43(92,93)49(104,105)55(116,117)61(129,130)131,19-11-32(70,71)38(82,83)44(94,95)50(106,107)56(118,119)62(132,133)134)28-5-1-26(2-6-28)23-144-15-16-145(25-144)24-27-3-7-29(8-4-27)147(20-12-33(72,73)39(84,85)45(96,97)51(108,109)57(120,121)63(135,136)137,21-13-34(74,75)40(86,87)46(98,99)52(110,111)58(122,123)64(138,139)140)22-14-35(76,77)41(88,89)47(100,101)53(112,113)59(124,125)65(141,142)143/h1-8,15-16,25H,9-14,17-24H2/q+1
InChI key: PUOYIKJSCYFHIH-UHFFFAOYSA-N
SMILES: n1(c[n+](cc1)Cc1ccc(cc1)[Si](CCC(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(CCC(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)CCC(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)Cc1ccc(cc1)[Si](CCC(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(CCC(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)CCC(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F
Systematic name  (3):
  • 1,3-ビス[4-[トリス(3,3,4,4,5,5,6,6,7,7,8,8,8-トリデカフルオロオクチル)シリル]ベンジル]-1H-イミダゾール-3-イウム
  • 1,3-ビス({4-[トリス(3,3,4,4,5,5,6,6,7,7,8,8,8-トリデカフルオロオクチル)シリル]フェニル}メチル)-1H-イミダゾール-3-イウム
  • 1,3-bis({4-[tris(3,3,4,4,5,5,6,6,7,7,8,8,8-tridecafluorooctyl)silyl]phenyl}methyl)-1H-imidazol-3-ium
Other name (2):
  • 1,3-ビス({4-[トリス(3,3,4,4,5,5,6,6,7,7,8,8,8-トリデカフルオロオクチル)シリル]フェニル}メチル)イミダゾール-1-イウム
  • 1,3-bis({4-[tris(3,3,4,4,5,5,6,6,7,7,8,8,8-tridecafluorooctyl)silyl]phenyl}methyl)imidazol-1-ium
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