Chem
J-GLOBAL ID：200907031741981397   Nikkaji number：J1.741.474G

1,1′,1′′-(2,4,6-Tributylbenzene-1,3,5-triyltrismethylene)tris(3,5-dimethyl-1H-pyrazole)

1,1′,1′′-(2,4,6-トリブチルベンゼン-1,3,5-トリイルトリスメチレン)トリス(3,5-ジメチル-1H-ピラゾール)
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： C36H54N6
Molecular formula furigana： C36-H54-N6
Molecular weight： 570.870
InChI： InChI=1S/C36H54N6/c1-10-13-16-31-34(22-40-28(7)19-25(4)37-40)32(17-14-11-2)36(24-42-30(9)21-27(6)39-42)33(18-15-12-3)35(31)23-41-29(8)20-26(5)38-41/h19-21H,10-18,22-24H2,1-9H3
InChI key： HAJJKVJHKMHPDC-UHFFFAOYSA-N
SMILES： CCCCc1c(Cn2nc(C)cc2C)c(CCCC)c(Cn2nc(C)cc2C)c(CCCC)c1Cn1nc(C)cc1C
Systematic name  (4)：
  • 1,1′,1′′-(2,4,6-トリブチルベンゼン-1,3,5-トリイルトリスメチレン)トリス(3,5-ジメチル-1H-ピラゾール)
  • 1,1′,1′′-[(2,4,6-トリブチル-1,3,5-ベンゼントリイル)トリスメチレン]トリス(3,5-ジメチル-1H-ピラゾール)
  • 3,5-ジメチル-1-({2,4,6-トリブチル-3,5-ビス[(3,5-ジメチル-1H-ピラゾール-1-イル)メチル]フェニル}メチル)-1H-ピラゾール
  • 3,5-dimethyl-1-({2,4,6-tributyl-3,5-bis[(3,5-dimethyl-1H-pyrazol-1-yl)methyl]phenyl}methyl)-1H-pyrazole
Other name (2)：
  • 1,1′,1′′-(2,4,6-Tributylbenzene-1,3,5-triyltrismethylene)tris(3,5-dimethyl-1H-pyrazole)
  • 1,1′,1′′-[(2,4,6-Tributyl-1,3,5-benzenetriyl)trismethylene]tris(3,5-dimethyl-1H-pyrazole)
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