Chem
J-GLOBAL ID：201807000737949168   Nikkaji number：J3.725.875J

9,9′-Ethylene-10,10′-[5-bromo-2-(isopropyloxy)-1,3-phenylenebis(methyleneoxyethyleneoxyethyleneoxy)]bis(anthracene)

9,9′-エチレン-10,10′-[5-ブロモ-2-(イソプロピルオキシ)-1,3-フェニレンビス(メチレンオキシエチレンオキシエチレンオキシ)]ビス(アントラセン)
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： C49H49BrO7
Molecular formula furigana： C49-H49-BR-O7
Molecular weight： 829.828
InChI： InChI=1S/C49H49BrO7/c1-33(2)57-47-34-29-36(50)30-35(47)32-54-24-22-52-26-28-56-49-45-17-9-5-13-39(45)42(40-14-6-10-18-46(40)49)20-19-41-37-11-3-7-15-43(37)48(44-16-8-4-12-38(41)44)55-27-25-51-21-23-53-31-34/h3-18,29-30,33H,19-28,31-32H2,1-2H3
InChI key： HOSVHQLULGMXBG-UHFFFAOYSA-N
SMILES： CC(C)Oc1c2COCCOCCOc3c4ccccc4c(CCc4c5ccccc5c(OCCOCCOCc1cc(Br)c2)c1ccccc41)c1ccccc31
Systematic name  (3)：
  • 9,9′-エチレン-10,10′-[5-ブロモ-2-(イソプロピルオキシ)-1,3-フェニレンビス(メチレンオキシエチレンオキシエチレンオキシ)]ビス(アントラセン)
  • 22-ブロモ-46-(プロパン-2-イルオキシ)-12,15,18,26,29,32-ヘキサオキサオクタシクロ[31.6.6.64,11.120,24.05,10.034,39.040,45.047,52]ドペンタコンタ-1(39),4,6,8,10,20,22,24(46),33,35,37,40,42,44,47,49,51-ヘプタデカエン
  • 22-bromo-46-(propan-2-yloxy)-12,15,18,26,29,32-hexaoxaoctacyclo[31.6.6.64,11.120,24.05,10.034,39.040,45.047,52]dopentaconta-1(39),4,6,8,10,20,22,24(46),33,35,37,40,42,44,47,49,51-heptadecaene
Other name (1)：
  • 9,9′-Ethylene-10,10′-[5-bromo-2-(isopropyloxy)-1,3-phenylenebis(methyleneoxyethyleneoxyethyleneoxy)]bis(anthracene)
Thsaurus map：
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