Chem
J-GLOBAL ID：200907061344992745   Nikkaji number：J2.629.112G

2,8,14,20,26,32-Hexabromo-6H,12H,18H,24H,30H,36H-hexabenzo[b,f,j,n,r,v][1,5,9,13,17,21]hexaoxacyclotetracosin-6,12,18,24,30,36-hexaone

2,8,14,20,26,32-ヘキサブロモ-6H,12H,18H,24H,30H,36H-ヘキサベンゾ[b,f,j,n,r,v][1,5,9,13,17,21]ヘキサオキサシクロテトラコシン-6,12,18,24,30,36-ヘキサオン
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： C42H18Br6O12
Molecular formula furigana： C42-H18-BR6-O12
Molecular weight： 1194.018
InChI： InChI=1S/C42H18Br6O12/c43-19-1-7-31-25(13-19)37(49)56-33-9-3-21(45)15-27(33)39(51)58-35-11-5-23(47)17-29(35)41(53)60-36-12-6-24(48)18-30(36)42(54)59-34-10-4-22(46)16-28(34)40(52)57-32-8-2-20(44)14-26(32)38(50)55-31/h1-18H
InChI key： UNBMGVCXGZCHHG-UHFFFAOYSA-N
SMILES： Brc1ccc2OC(=O)c3cc(Br)ccc3OC(=O)c3cc(Br)ccc3OC(=O)c3cc(Br)ccc3OC(=O)c3cc(Br)ccc3OC(=O)c3cc(Br)ccc3OC(=O)c2c1
Systematic name  (4)：
  • 1,2-(3-ブロモ-1,3-ブタジエン-1,4-ジイル)-5,6-(3-ブロモ-1,3-ブタジエン-1,4-ジイル)-9,10-(3-ブロモ-1,3-ブタジエン-1,4-ジイル)-13,14-(3-ブロモ-1,3-ブタジエン-1,4-ジイル)-17,18-(3-ブロモ-1,3-ブタジエン-1,4-ジイル)-21,22-(3-ブロモ-1,3-ブタジエン-1,4-ジイル)-4,8,12,16,20,24-ヘキサオキサシクロテトラコサン-1,5,9,13,17,21-ヘキサエン-3,7,11,15,19,23-ヘキサオン
  • 2,8,14,20,26,32-ヘキサブロモ-6H,12H,18H,24H,30H,36H-ヘキサベンゾ[b,f,j,n,r,v][1,5,9,13,17,21]ヘキサオキサシクロテトラコシン-6,12,18,24,30,36-ヘキサオン
  • 6,14,22,30,38,46-ヘキサブロモ-2,10,18,26,34,42-ヘキサオキサヘプタシクロ[42.4.0.04,9.012,17.020,25.028,33.036,41]オクタテトラコンタ-1(48),4,6,8,12,14,16,20,22,24,28,30,32,36,38,40,44,46-オクタデカエン-3,11,19,27,35,43-ヘキサオン
  • 6,14,22,30,38,46-hexabromo-2,10,18,26,34,42-hexaoxaheptacyclo[42.4.0.04,9.012,17.020,25.028,33.036,41]octatetraconta-1(48),4,6,8,12,14,16,20,22,24,28,30,32,36,38,40,44,46-octadecaene-3,11,19,27,35,43-hexone
Other name (2)：
  • 1,2-(3-Bromo-1,3-butadiene-1,4-diyl)-5,6-(3-bromo-1,3-butadiene-1,4-diyl)-9,10-(3-bromo-1,3-butadiene-1,4-diyl)-13,14-(3-bromo-1,3-butadiene-1,4-diyl)-17,18-(3-bromo-1,3-butadiene-1,4-diyl)-21,22-(3-bromo-1,3-butadiene-1,4-diyl)-4,8,12,16,20,24-hexaoxacyclotetracosane-1,5,9,13,17,21-hexaene-3,7,11,15,19,23-hexaone
  • 2,8,14,20,26,32-Hexabromo-6H,12H,18H,24H,30H,36H-hexabenzo[b,f,j,n,r,v][1,5,9,13,17,21]hexaoxacyclotetracosin-6,12,18,24,30,36-hexaone
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