Chem
J-GLOBAL ID:200907001620504919   Nikkaji number:J1.058.095A

2,2′-[[(2S,3S)-1,4-Bis(hydroxymethyl)butane-2,3-diyl]bis(nitrilomethylidyne)]bis(4,6-ditert-butylphenol)

(3S,4S)-3,4-ビス({[(3,5-ジ-tert-ブチル-2-ヒドロキシフェニル)メチリデン]アミノ})ヘキサン-1,6-ジオール
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: C36H56N2O4
Molecular formula furigana: C36-H56-N2-O4
Molecular weight: 580.854
InChI: InChI=1S/C36H56N2O4/c1-33(2,3)25-17-23(31(41)27(19-25)35(7,8)9)21-37-29(13-15-39)30(14-16-40)38-22-24-18-26(34(4,5)6)20-28(32(24)42)36(10,11)12/h17-22,29-30,39-42H,13-16H2,1-12H3/t29-,30-/m0/s1
InChI key: FQAQWAOLDKOMHZ-KYJUHHDHSA-N
SMILES: CC(C)(C)c1cc(C=N[C@@H](CCO)[C@H](CCO)N=Cc2cc(cc(c2O)C(C)(C)C)C(C)(C)C)c(O)c(c1)C(C)(C)C
Systematic name  (3):
  • 2,2′-[[(2S,3S)-1,4-ビス(ヒドロキシメチル)ブタン-2,3-ジイル]ビス(ニトリロメチリジン)]ビス(4,6-ジtert-ブチルフェノール)
  • (3S,4S)-3,4-ビス({[(3,5-ジ-tert-ブチル-2-ヒドロキシフェニル)メチリデン]アミノ})ヘキサン-1,6-ジオール
  • (3S,4S)-3,4-bis({[(3,5-di-tert-butyl-2-hydroxyphenyl)methylidene]amino})hexane-1,6-diol
Other name (1):
  • 2,2′-[[(2S,3S)-1,4-Bis(hydroxymethyl)butane-2,3-diyl]bis(nitrilomethylidyne)]bis(4,6-ditert-butylphenol)
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