Chem
J-GLOBAL ID：200907008097984647   Nikkaji number：J1.529.388H

3,3′-Ethylenebis[1-(chloromethyl)-2-methyl-5-tert-butylbenzene]

3,3′-エチレンビス[1-(クロロメチル)-2-メチル-5-tert-ブチルベンゼン]
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： C26H36Cl2
Molecular formula furigana： C26-H36-CL2
Molecular weight： 419.470
InChI： InChI=1S/C26H36Cl2/c1-17-19(11-23(25(3,4)5)13-21(17)15-27)9-10-20-12-24(26(6,7)8)14-22(16-28)18(20)2/h11-14H,9-10,15-16H2,1-8H3
InChI key： IMYKRGKOCPVOIA-UHFFFAOYSA-N
SMILES： Cc1c(CCl)cc(cc1CCc1cc(cc(CCl)c1C)C(C)(C)C)C(C)(C)C
Systematic name  (3)：
  • 3,3′-エチレンビス[1-(クロロメチル)-2-メチル-5-tert-ブチルベンゼン]
  • 5-tert-ブチル-1-{2-[5-tert-ブチル-3-(クロロメチル)-2-メチルフェニル]エチル}-3-(クロロメチル)-2-メチルベンゼン
  • 5-tert-butyl-1-{2-[5-tert-butyl-3-(chloromethyl)-2-methylphenyl]ethyl}-3-(chloromethyl)-2-methylbenzene
Other name (1)：
  • 3,3′-Ethylenebis[1-(chloromethyl)-2-methyl-5-tert-butylbenzene]
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