Chem
J-GLOBAL ID：200907084164180653   Nikkaji number：J2.490.788K

3,3′-[Thiobis[[2-(trifluoromethylsulfonyloxy)-5-tert-butyl-1,3-phenylene]thio]][1,1′-thiobis(2-methoxy-5-tert-butylbenzene)]

3,3′-[チオビス[[2-(トリフルオロメチルスルホニルオキシ)-5-tert-ブチル-1,3-フェニレン]チオ]][1,1′-チオビス(2-メトキシ-5-tert-ブチルベンゼン)]
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： C44H50F6O8S6
Molecular formula furigana： C44-H50-F6-O8-S6
Molecular weight： 1013.230
InChI： InChI=1S/C44H50F6O8S6/c1-39(2,3)23-15-27-35(55-13)29(17-23)60-31-19-25(41(7,8)9)21-33(37(31)57-63(51,52)43(45,46)47)62-34-22-26(42(10,11)12)20-32(38(34)58-64(53,54)44(48,49)50)61-30-18-24(40(4,5)6)16-28(59-27)36(30)56-14/h15-22H,1-14H3
InChI key： MUUBAACKHXOCMI-UHFFFAOYSA-N
SMILES： COc1c2cc(cc1Sc1cc(cc(Sc3cc(cc(Sc4cc(cc(S2)c4OC)C(C)(C)C)c3OS(=O)(=O)C(F)(F)F)C(C)(C)C)c1OS(=O)(=O)C(F)(F)F)C(C)(C)C)C(C)(C)C
Systematic name  (3)：
  • 3,3′-[チオビス[[2-(トリフルオロメチルスルホニルオキシ)-5-tert-ブチル-1,3-フェニレン]チオ]][1,1′-チオビス(2-メトキシ-5-tert-ブチルベンゼン)]
  • 5,11,17,23-テトラ-tert-ブチル-26,27-ジメトキシ-28-(トリフルオロメタンスルホニルオキシ)-2,8,14,20-テトラチアペンタシクロ[19.3.1.13,7.19,13.115,19]オクタコサ-1(25),3,5,7(28),9(27),10,12,15,17,19(26),21,23-ドデカエン-25-イル トリフルオロメタンスルホナート
  • 5,11,17,23-tetra-tert-butyl-26,27-dimethoxy-28-(trifluoromethanesulfonyloxy)-2,8,14,20-tetrathiapentacyclo[19.3.1.13,7.19,13.115,19]octacosa-1(25),3,5,7(28),9(27),10,12,15,17,19(26),21,23-dodecaen-25-yl trifluoromethanesulfonate
Other name (1)：
  • 3,3′-[Thiobis[[2-(trifluoromethylsulfonyloxy)-5-tert-butyl-1,3-phenylene]thio]][1,1′-thiobis(2-methoxy-5-tert-butylbenzene)]
Thsaurus map：
Thesaurus Map

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