Chem
J-GLOBAL ID：200907026195686210   Nikkaji number：J1.120.926B

2,2′-(1,10-Phenanthroline-2,9-diyl)-6,6′-[[(1S,2S)-cyclohexane-1,2-diyl]bis(nitrilomethylidyne)]bis[4-tert-butylphenol]

2,2′-(1,10-フェナントロリン-2,9-ジイル)-6,6′-[[(1S,2S)-シクロヘキサン-1,2-ジイル]ビス(ニトリロメチリジン)]ビス[4-tert-ブチルフェノール]
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： C40H42N4O2
Molecular formula furigana： C40-H42-N4-O2
Molecular weight： 610.802
InChI： InChI=1S/C40H42N4O2/c1-39(2,3)27-17-25-21-41-33-9-7-8-10-34(33)42-22-26-18-28(40(4,5)6)20-30(38(26)46)32-16-14-24-12-11-23-13-15-31(29(19-27)37(25)45)43-35(23)36(24)44-32/h11-22,33-34,45-46H,7-10H2,1-6H3/t33-,34-/m0/s1
InChI key： JTTYXYKMXKSAPS-HEVIKAOCSA-N
SMILES： CC(C)(C)c1cc2C=N[C@H]3CCCC[C@@H]3N=Cc3cc(cc(c4ccc5ccc6ccc(nc6c5n4)c(c1)c2O)c3O)C(C)(C)C
Systematic name  (3)：
  • 2,2′-(1,10-フェナントロリン-2,9-ジイル)-6,6′-[[(1S,2S)-シクロヘキサン-1,2-ジイル]ビス(ニトリロメチリジン)]ビス[4-tert-ブチルフェノール]
  • (9S,14S)-4,19-ジ-tert-ブチル-8,15,31,34-テトラアザヘプタシクロ[20.8.4.12,6.117,21.09,14.025,33.028,32]ヘキサトリアコンタ-1(30),2,4,6(36),7,15,17,19,21(35),22,24,26,28,31,33-ペンタデカエン-35,36-ジオール
  • (9S,14S)-4,19-di-tert-butyl-8,15,31,34-tetraazaheptacyclo[20.8.4.12,6.117,21.09,14.025,33.028,32]hexatriaconta-1(30),2,4,6(36),7,15,17,19,21(35),22,24,26,28,31,33-pentadecaene-35,36-diol
Other name (1)：
  • 2,2′-(1,10-Phenanthroline-2,9-diyl)-6,6′-[[(1S,2S)-cyclohexane-1,2-diyl]bis(nitrilomethylidyne)]bis[4-tert-butylphenol]
Thsaurus map：
Thesaurus Map

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