Chem
J-GLOBAL ID：200907095689683682   Nikkaji number：J107.267F

5-tert-Butyl-m-xylene

5-tert-ブチル-m-キシレン
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： C12H18
Molecular formula furigana： C12-H18
Molecular weight： 162.276
InChI： InChI=1S/C12H18/c1-9-6-10(2)8-11(7-9)12(3,4)5/h6-8H,1-5H3
InChI key： FZSPYHREEHYLCB-UHFFFAOYSA-N
SMILES： Cc1cc(C)cc(c1)C(C)(C)C
Systematic name  (7)：
  • 5-(1,1-ジメチルエチル)-1,3-ジメチルベンゼン
  • 1,3-ジメチル-5-(1,1-ジメチルエチル)ベンゼン
  • 1,3-ジメチル-5-tert-ブチルベンゼン
  • 1-tert-ブチル-3,5-ジメチルベンゼン
  • 1-(1,1-ジメチルエチル)-3,5-ジメチルベンゼン
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Other name (4)：
  • 5-tert-Butyl-m-xylene
  • 1-tert-Butyl-3,5-dimethylbenzene
  • 1-(1,1-Dimethylethyl)-3,5-dimethylbenzene
  • 1,3-Dimethyl-5-tert-butylbenzene
CAS registry number： 98-19-1
Regulation number (3)：
  • ZE3900000
  • EINECS2026476
  • TSCA(98-19-1)
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