Chem
J-GLOBAL ID：200907025517390995   Nikkaji number：J1.529.387J

3,3′-Tetramethylenebis[2-methyl-5-tert-butylbenzeneacetonitrile]

3,3′-テトラメチレンビス[2-メチル-5-tert-ブチルベンゼンアセトニトリル]
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： C30H40N2
Molecular formula furigana： C30-H40-N2
Molecular weight： 428.664
InChI： InChI=1S/C30H40N2/c1-21-23(17-27(29(3,4)5)19-25(21)13-15-31)11-9-10-12-24-18-28(30(6,7)8)20-26(14-16-32)22(24)2/h17-20H,9-14H2,1-8H3
InChI key： VBYBJUJTVCBNBP-UHFFFAOYSA-N
SMILES： Cc1c(CCCCc2cc(cc(CC#N)c2C)C(C)(C)C)cc(cc1CC#N)C(C)(C)C
Systematic name  (3)：
  • 3,3′-テトラメチレンビス[2-メチル-5-tert-ブチルベンゼンアセトニトリル]
  • 2-(5-tert-ブチル-3-{4-[5-tert-ブチル-3-(シアノメチル)-2-メチルフェニル]ブチル}-2-メチルフェニル)アセトニトリル
  • 2-(5-tert-butyl-3-{4-[5-tert-butyl-3-(cyanomethyl)-2-methylphenyl]butyl}-2-methylphenyl)acetonitrile
Other name (1)：
  • 3,3′-Tetramethylenebis[2-methyl-5-tert-butylbenzeneacetonitrile]
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