(2S)-2-Benzyl-4-(3,4-Dichlorophenyl)-4-Oxobutanoic Acid

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Properties Simple | Detailed

Formula C17H14Cl2O3
IUPAC Name (2s)-2-benzyl-4-(3,4-dichlorophenyl)-4-oxo-butanoic acid
Molecular Mass 337.197 g·mol−1
Heat of Formation -466.5 ± 16.7 kJ·mol−1
Dipole Moment 1.96 ± 1.08 D
Volume 373.02 Å 3
Surface Area 291.56 Å 2
HOMO Energy -9.69 ± 0.55 eV
LUMO Energy -1.01 ± eV
Point Group Symmetry C1
Synonyms
  • (2s)-2-(benzyl)-4-(3,4-dichlorophenyl)-4-keto-butyric acid
  • (2s)-4-(3,4-dichlorophenyl)-4-oxo-2-(phenylmethyl)butanoic acid
InChIKey HDNBCXYCBKIQMU-ZDUSSCGKSA-N
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Elements H C O Cl