Chem
J-GLOBAL ID：200907004964786904
Nikkaji number：J645.161F
3-Phenyl-2,5-hexanedione
3-フェニル-2,5-ヘキサンジオン
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/c1-9(13)8-12(10(2)14)11-6-4-3-5-7-11/h3-7,12H,8H2,1-2H3
InChI key：
FXPCGHUTBCPZHN-UHFFFAOYSA-N
SMILES：
CC(=O)CC(C(=O)C)c1ccccc1
Systematic name (3)：
- 3-フェニル-2,5-ヘキサンジオン
- 3-フェニルヘキサン-2,5-ジオン
- 3-phenylhexane-2,5-dione
- 3-Phenyl-2,5-hexanedione
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