Chem
J-GLOBAL ID：200907006072234179   Nikkaji number：J534.953B

Phthalic acid 1-(2-ethyl-5-oxohexyl) ester

フタル酸1-(2-エチル-5-オキソヘキシル)
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： C16H20O5
Molecular formula furigana： C16-H20-O5
Molecular weight： 292.331
InChI： InChI=1S/C16H20O5/c1-3-12(9-8-11(2)17)10-21-16(20)14-7-5-4-6-13(14)15(18)19/h4-7,12H,3,8-10H2,1-2H3,(H,18,19)
InChI key： HCWNFKHKKHNSSL-UHFFFAOYSA-N
SMILES： CCC(CCC(=O)C)COC(=O)c1ccccc1C(=O)O
Systematic name  (5)：
  • フタル酸水素1-(2-エチル-5-オキソヘキシル)
  • フタル酸1-(5-オキソ-2-エチルヘキシル)
  • フタル酸1-(2-エチル-5-オキソヘキシル)
  • 2-{[(2-エチル-5-オキソヘキシル)オキシ]カルボニル}安息香酸
  • 2-{[(2-ethyl-5-oxohexyl)oxy]carbonyl}benzoic acid
Other name (3)：
  • Phthalic acid hydrogen 1-(2-ethyl-5-oxohexyl) ester
  • Phthalic acid 1-(5-oxo-2-ethylhexyl) ester
  • Phthalic acid 1-(2-ethyl-5-oxohexyl) ester
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