Chem
J-GLOBAL ID：200907059510662967   Nikkaji number：J752.060C

2-(2,4,5-Trifluorobenzoyl)acetic acid ethyl ester

2-(2,4,5-トリフルオロベンゾイル)酢酸エチル
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： C11H9F3O3
Molecular formula furigana： C11-H9-F3-O3
Molecular weight： 246.185
InChI： InChI=1S/C11H9F3O3/c1-2-17-11(16)5-10(15)6-3-8(13)9(14)4-7(6)12/h3-4H,2,5H2,1H3
InChI key： OTCJYVJORKMTHX-UHFFFAOYSA-N
SMILES： CCOC(=O)CC(=O)c1cc(F)c(F)cc1F
Systematic name  (4)：
  • 3-オキソ-3-(2,4,5-トリフルオロフェニル)プロピオン酸エチル
  • 2-(2,4,5-トリフルオロベンゾイル)酢酸エチル
  • エチル 3-オキソ-3-(2,4,5-トリフルオロフェニル)プロパノアート
  • ethyl 3-oxo-3-(2,4,5-trifluorophenyl)propanoate
Other name (2)：
  • 3-Oxo-3-(2,4,5-trifluorophenyl)propionic acid ethyl ester
  • 2-(2,4,5-Trifluorobenzoyl)acetic acid ethyl ester
Regulation number (1)：
  • 4-(7)-2000
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