Chem
J-GLOBAL ID：200907016434067166   Nikkaji number：J1.005.074J

2,2′,2′′-(1,3,5-Benzenetriyl)tris[1-(4-tert-butylphenyl)-1,2-ethanedione]

2,2′,2′′-(1,3,5-ベンゼントリイル)トリス[1-(4-tert-ブチルフェニル)-1,2-エタンジオン]
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： C42H42O6
Molecular formula furigana： C42-H42-O6
Molecular weight： 642.792
InChI： InChI=1S/C42H42O6/c1-40(2,3)31-16-10-25(11-17-31)34(43)37(46)28-22-29(38(47)35(44)26-12-18-32(19-13-26)41(4,5)6)24-30(23-28)39(48)36(45)27-14-20-33(21-15-27)42(7,8)9/h10-24H,1-9H3
InChI key： LZGALEUXVYGSEB-UHFFFAOYSA-N
SMILES： CC(C)(C)c1ccc(cc1)C(=O)C(=O)c1cc(cc(c1)C(=O)C(=O)c1ccc(cc1)C(C)(C)C)C(=O)C(=O)c1ccc(cc1)C(C)(C)C
Systematic name  (3)：
  • 2,2′,2′′-(1,3,5-ベンゼントリイル)トリス[1-(4-tert-ブチルフェニル)-1,2-エタンジオン]
  • 1-{3,5-ビス[2-(4-tert-ブチルフェニル)-2-オキソアセチル]フェニル}-2-(4-tert-ブチルフェニル)エタン-1,2-ジオン
  • 1-{3,5-bis[2-(4-tert-butylphenyl)-2-oxoacetyl]phenyl}-2-(4-tert-butylphenyl)ethane-1,2-dione
Other name (1)：
  • 2,2′,2′′-(1,3,5-Benzenetriyl)tris[1-(4-tert-butylphenyl)-1,2-ethanedione]
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