Chem
J-GLOBAL ID：200907012662929717   Nikkaji number：J433.792A

α-Methylbenzenebutyric acid methyl ester

α-メチルベンゼン酪酸メチル
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： C12H16O2
Molecular formula furigana： C12-H16-O2
Molecular weight： 192.258
InChI： InChI=1S/C12H16O2/c1-10(12(13)14-2)8-9-11-6-4-3-5-7-11/h3-7,10H,8-9H2,1-2H3
InChI key： KEIGTQPTFNQBMC-UHFFFAOYSA-N
SMILES： COC(=O)C(C)CCc1ccccc1
Systematic name  (5)：
  • 4-フェニル-2-メチルブタン酸メチル
  • α-メチルベンゼンブタン酸メチル
  • α-メチルベンゼン酪酸メチル
  • メチル 2-メチル-4-フェニルブタノアート
  • methyl 2-methyl-4-phenylbutanoate
Other name (3)：
  • 4-Phenyl-2-methylbutanoic acid methyl ester
  • α-Methylbenzenebutanoic acid methyl ester
  • α-Methylbenzenebutyric acid methyl ester
Regulation number (1)：
  • (3)-1730
Thsaurus map：
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