Chem
J-GLOBAL ID：200907040123768614   Nikkaji number：J1.054.060G

p-tert-Butylthiacalix[6]arene

p-tert-ブチルチアカリックス[6]アレーン
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： C60H72O6S6
Molecular formula furigana： C60-H72-O6-S6
Molecular weight： 1081.590
InChI： InChI=1S/C60H72O6S6/c1-55(2,3)31-19-37-49(61)38(20-31)68-40-22-33(57(7,8)9)24-42(51(40)63)70-44-26-35(59(13,14)15)28-46(53(44)65)72-48-30-36(60(16,17)18)29-47(54(48)66)71-45-27-34(58(10,11)12)25-43(52(45)64)69-41-23-32(56(4,5)6)21-39(67-37)50(41)62/h19-30,61-66H,1-18H3
InChI key： YNXNLZZVAGTOAO-UHFFFAOYSA-N
SMILES： CC(C)(C)c1cc2Sc3cc(cc(Sc4cc(cc(Sc5cc(cc(Sc6cc(cc(Sc7cc(cc(Sc(c1)c2O)c7O)C(C)(C)C)c6O)C(C)(C)C)c5O)C(C)(C)C)c4O)C(C)(C)C)c3O)C(C)(C)C
Systematic name  (6)：
  • 2,6′-チオ-2′,6′′-チオ-2′′,6′′′-チオ-2′′′,6′′′′-チオ-2′′′′,6′′′′′-チオ-2′′′′′,6-チオヘキサキス(4-tert-ブチルフェノール)
  • 2,8,14,20,26,32-ヘキサチア-5,11,17,23,29,35-ヘキサ-tert-ブチルヘプタシクロ[31.3.1.13,7.19,13.115,19.121,25.127,31]ドテトラコンタ-1(37),3,5,7(42),9,11,13(41),15,17,19(40),21,23,25(39),27,29,31(38),33,35-オクタデカエン-37,38,39,40,41,42-ヘキサオール
  • 5,11,17,23,29,35-ヘキサキス-tert-ブチル-2,8,14,20,26,32-ヘキサチアヘプタシクロ[31.3.1.13,7.19,13.115,19.121,25.127,31]ドテトラコンタ-1(37),3,5,7(42),9,11,13(41),15,17,19(40),21,23,25(39),27,29,31(38),33,35-オクタデカエン-37,38,39,40,41,42-ヘキサオール
  • 5,11,17,23,29,35-ヘキサ-tert-ブチル-2,8,14,20,26,32-ヘキサチアヘプタシクロ[31.3.1.13,7.19,13.115,19.121,25.127,31]ドテトラコンタ-1(37),3,5,7(42),9,11,13(41),15,17,19(40),21,23,25(39),27,29,31(38),33,35-オクタデカエン-37,38,39,40,41,42-ヘキサオール
  • 5,11,17,23,29,35-ヘキサ-tert-ブチル-2,8,14,20,26,32-ヘキサチアヘプタシクロ[31.3.1.13,7.19,13.115,19.121,25.127,31]ドテトラコンタ-1(37),3,5,7(42),9,11,13(41),15,17,19(40),21,23,25(39),27(38),28,30,33,35-オクタデカエン-37,38,39,40,41,42-ヘキサオール
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Other name (6)：
  • 5,11,17,23,29,35-Hexa-tert-butyl-2,8,14,20,26,32-hexathiaheptacyclo[31.3.1.13,7.19,13.115,19.121,25.127,31]dotetraconta-1(37),3,5,7(42),9,11,13(41),15,17,19(40),21,23,25(39),27,29,31(38),33,35-octadecene-37,38,39,40,41,42-hexol
  • 5,11,17,23,29,35-Hexakis-tert-butyl-2,8,14,20,26,32-hexathiaheptacyclo[31.3.1.13,7.19,13.115,19.121,25.127,31]dotetraconta-1(37),3,5,7(42),9,11,13(41),15,17,19(40),21,23,25(39),27,29,31(38),33,35-octadecene-37,38,39,40,41,42-hexol
  • 2,8,14,20,26,32-Hexathia-5,11,17,23,29,35-hexa-tert-butylheptacyclo[31.3.1.13,7.19,13.115,19.121,25.127,31]dotetraconta-1(37),3,5,7(42),9,11,13(41),15,17,19(40),21,23,25(39),27,29,31(38),33,35-octadecene-37,38,39,40,41,42-hexol
  • p-tert-ブチルチアカリックス[6]アレーン
  • p-tert-Butylthiacalix[6]arene
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