Chem
J-GLOBAL ID：200907090117702218   Nikkaji number：J372.955I

KK-42

KK-42
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： C19H24N2
Molecular formula furigana： C19-H24-N2
Molecular weight： 280.415
InChI： InChI=1S/C19H24N2/c1-16(2)8-7-9-17(3)12-19-13-20-15-21(19)14-18-10-5-4-6-11-18/h4-6,8,10-13,15H,7,9,14H2,1-3H3/b17-12+
InChI key： JLGZMQRNESBDEI-SFQUDFHCSA-N
SMILES： CC(=CCC/C(=C/c1cncn1Cc1ccccc1)/C)C
Systematic name  (4)：
  • 1-ベンジル-5-[(1E)-2,6-ジメチル-1,5-ヘプタジエニル]-1H-イミダゾール
  • 1-ベンジル-5-[(1E)-2,6-ジメチル-1,5-ヘプタジエン-1-イル]-1H-イミダゾール
  • 1-ベンジル-5-[(1E)-2,6-ジメチルヘプタ-1,5-ジエン-1-イル]-1H-イミダゾール
  • 1-benzyl-5-[(1E)-2,6-dimethylhepta-1,5-dien-1-yl]-1H-imidazole
Other name (2)：
  • KK-42
  • 1-Benzyl-5-[(1E)-2,6-dimethyl-1,5-heptadien-1-yl]-1H-imidazole
CAS registry number： 96108-89-3
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