Chem
J-GLOBAL ID：200907095378638942
Nikkaji number：J609.431G
4-Butylbenzeneacetic acid methyl ester
4-ブチルベンゼン酢酸メチル
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
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
Molecular formula： C13H18O2
Molecular formula furigana： C13-H18-O2
Molecular weight： 206.285
InChI：
InChI=1S/C13H18O2/c1-3-4-5-11-6-8-12(9-7-11)10-13(14)15-2/h6-9H,3-5,10H2,1-2H3
InChI key：
OGXWENQUBCGNFG-UHFFFAOYSA-N
SMILES：
CCCCc1ccc(CC(=O)OC)cc1
Systematic name (3)：
- 4-ブチルベンゼン酢酸メチル
- メチル 2-(4-ブチルフェニル)アセタート
- methyl 2-(4-butylphenyl)acetate
- 4-Butylbenzeneacetic acid methyl ester
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