Chem
J-GLOBAL ID：200907019173038936   Nikkaji number：J2.228.067H

α-Phenacylbenzylmalonic acid dibutyl ester

α-フェナシルベンジルマロン酸ジブチル
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： C26H32O5
Molecular formula furigana： C26-H32-O5
Molecular weight： 424.537
InChI： InChI=1S/C26H32O5/c1-3-5-17-30-25(28)24(26(29)31-18-6-4-2)22(20-13-9-7-10-14-20)19-23(27)21-15-11-8-12-16-21/h7-16,22,24H,3-6,17-19H2,1-2H3
InChI key： RAOKHHLITDKELZ-UHFFFAOYSA-N
SMILES： CCCCOC(=O)C(C(CC(=O)c1ccccc1)c1ccccc1)C(=O)OCCCC
Systematic name  (4)：
  • α-フェナシルベンジルマロン酸ジブチル
  • 2-(1,3-ジフェニル-3-オキソプロピル)マロン酸ジブチル
  • 1,3-ジブチル 2-(3-オキソ-1,3-ジフェニルプロピル)プロパンジオアート
  • 1,3-dibutyl 2-(3-oxo-1,3-diphenylpropyl)propanedioate
Other name (2)：
  • α-Phenacylbenzylmalonic acid dibutyl ester
  • 2-(1,3-Diphenyl-3-oxopropyl)malonic acid dibutyl ester
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