Chem
J-GLOBAL ID：200907083118253577   Nikkaji number：J209.061I

2-(Trifluoroacetyl)acetic acid methyl ester

2-(トリフルオロアセチル)酢酸メチル
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： C5H5F3O3
Molecular formula furigana： C5-H5-F3-O3
Molecular weight： 170.087
InChI： InChI=1S/C5H5F3O3/c1-11-4(10)2-3(9)5(6,7)8/h2H2,1H3
InChI key： LKMUBWWZTSZGGV-UHFFFAOYSA-N
SMILES： COC(=O)CC(=O)C(F)(F)F
Systematic name  (8)：
  • 2-(トリフルオロアセチル)酢酸メチル
  • 4,4,4-トリフルオロアセト酢酸メチル
  • 3-オキソ-4,4,4-トリフルオロブタン酸メチル
  • 4,4,4-トリフルオロ-3-オキソ酪酸メチル
  • トリフルオロアセチル酢酸メチル
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Other name (8)：
  • 4,4,4-Trifluoroacetoacetic acid methyl ester
  • 3-Oxo-4,4,4-trifluorobutanoic acid methyl ester
  • 4,4,4-Trifluoro-3-oxobutyric acid methyl ester
  • Trifluoroacetylacetic acid methyl ester
  • 4,4,4-Trifluoro-3-oxobutanoic acid methyl ester
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CAS registry number： 83643-84-9
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