Chem
J-GLOBAL ID：200907041737352127   Nikkaji number：J1.846.619H

7-(1,1,2-Trichloroethyl)-10-(4-methoxyphenyl)-7,10-dihydro-1,1′,10,10′-(1,1,2,2-ethenetetryl)-1′′,6′,7′,10′′-(1,1,2,2-ethenetetryl)-6,6′′,7,7′′-(1,1,2,2-ethenetetryl)-4,3,3′,4′,3′′,4′′-(1,2,3,4,5,6-benzenehexyl)-5,5′′:8,8′′:8′,9′′:9,9′-tetrakiscyclo-2,2′:5′,2′′-terfluoranthene

7-(1,1,2-トリクロロエチル)-10-(4-メトキシフェニル)-7,10-ジヒドロ-1,1′,10,10′-(1,1,2,2-エテンテトライル)-1′′,6′,7′,10′′-(1,1,2,2-エテンテトライル)-6,6′′,7,7′′-(1,1,2,2-エテンテトライル)-4,3,3′,4′,3′′,4′′-(1,2,3,4,5,6-ベンゼンヘキサイル)-5,5′′:8,8′′:8′,9′′:9,9′-テトラキスシクロ-2,2′:5′,2′′-テルフルオランテン
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： C69H9Cl3O
Molecular formula furigana： C69-H9-CL3-O
Molecular weight： 960.180
InChI： InChI=1S/C69H9Cl3O/c1-73-8-4-2-7(3-5-8)68-61-53-44-37-24-17-11-12-14-10-9-13(11)22(24)28-26-15(9)19-16(10)27-29-23(14)25-18(12)21-20(17)31-39-32(21)41-38(25)45-43(29)47-34(27)36-30(19)35-33(26)46(42(28)44)57(61)59-48(35)49(36)60-58(47)62-54(45)51(41)56-52(39)55(50(53)40(31)37)63(68)65(56)69(62,66(60)64(59)68)67(71,72)6-70/h2-5H,6H2,1H3
InChI key： MBOZGUPEUIBPGA-UHFFFAOYSA-N
SMILES： COc1ccc(cc1)C12c3c4c5c6c7c8c9c%10c(c1c1c%10c%10c%11c%12c1c1c2c2c3c3c5c5c%13c6c6c8c8c9c%10c9c%11c%10c%11c%12c1c1c2c2c3c5c3c5c2c1c%11c1c5c2c3c%13c6c3c8c9c(c23)c%101)C47C(Cl)(Cl)CCl
Systematic name  (3)：
  • 7-(1,1,2-トリクロロエチル)-10-(4-メトキシフェニル)-7,10-ジヒドロ-1,1′,10,10′-(1,1,2,2-エテンテトライル)-1′′,6′,7′,10′′-(1,1,2,2-エテンテトライル)-6,6′′,7,7′′-(1,1,2,2-エテンテトライル)-4,3,3′,4′,3′′,4′′-(1,2,3,4,5,6-ベンゼンヘキサイル)-5,5′′:8,8′′:8′,9′′:9,9′-テトラキスシクロ-2,2′:5′,2′′-テルフルオランテン
  • 31-(4-メトキシフェニル)-3-(1,1,2-トリクロロエチル)ヘントリアコンタシクロ[14.14.26.12,12.115,22.119,49.126,29.03,11.04,8.05,31.06,41.07,51.09,53.010,55.013,56.014,27.017,21.018,54.020,47.023,46.024,36.030,33.032,40.034,38.037,45.039,43.042,50.044,48.025,59.028,60.035,58.052,57]ヘキサコンタ-1,4,6,8,10,12(60),13(56),14(27),15,17(21),18,20(47),22(59),23(46),24(36),25,28,30(33),32(40),34(38),35(58),37(45),39(43),41,44(48),49(57),50,52,54-ノナコサエン
  • 31-(4-methoxyphenyl)-3-(1,1,2-trichloroethyl)hentriacontacyclo[14.14.26.12,12.115,22.119,49.126,29.03,11.04,8.05,31.06,41.07,51.09,53.010,55.013,56.014,27.017,21.018,54.020,47.023,46.024,36.030,33.032,40.034,38.037,45.039,43.042,50.044,48.025,59.028,60.035,58.052,57]hexaconta-1,4,6,8,10,12(60),13(56),14(27),15,17(21),18,20(47),22(59),23(46),24(36),25,28,30(33),32(40),34(38),35(58),37(45),39(43),41,44(48),49(57),50,52,54-nonacosaene
Other name (1)：
  • 7-(1,1,2-Trichloroethyl)-10-(4-methoxyphenyl)-7,10-dihydro-1,1′,10,10′-(1,1,2,2-ethenetetryl)-1′′,6′,7′,10′′-(1,1,2,2-ethenetetryl)-6,6′′,7,7′′-(1,1,2,2-ethenetetryl)-4,3,3′,4′,3′′,4′′-(1,2,3,4,5,6-benzenehexyl)-5,5′′:8,8′′:8′,9′′:9,9′-tetrakiscyclo-2,2′:5′,2′′-terfluoranthene
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