Chem
J-GLOBAL ID：200907017337976166
Nikkaji number：J2.618.366I
1-(4-Methylphenyl)-2-methyl-1,3-butanedione
1-(4-メチルフェニル)-2-メチル-1,3-ブタンジオン
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： C12H14O2
Molecular formula furigana： C12-H14-O2
Molecular weight： 190.242
InChI：
InChI=1S/C12H14O2/c1-8-4-6-11(7-5-8)12(14)9(2)10(3)13/h4-7,9H,1-3H3
InChI key：
BWLWSLLKZMFJEZ-UHFFFAOYSA-N
SMILES：
CC(C(=O)C)C(=O)c1ccc(C)cc1
Systematic name (3)：
- 1-(4-メチルフェニル)-2-メチル-1,3-ブタンジオン
- 2-メチル-1-(4-メチルフェニル)ブタン-1,3-ジオン
- 2-methyl-1-(4-methylphenyl)butane-1,3-dione
- 1-(4-Methylphenyl)-2-methyl-1,3-butanedione
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