Ethyl 3-(4-Chlorophenyl)-3-Oxopropanoate

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Properties Simple | Detailed

Formula C11H11ClO3
IUPAC Name ethyl 3-(4-chlorophenyl)-3-oxo-propanoate
Molecular Mass 226.656 g·mol−1
Heat of Formation -483.7 ± 16.7 kJ·mol−1
Dipole Moment 3.45 ± 1.08 D
Volume 255.92 Å 3
Surface Area 253.07 Å 2
HOMO Energy -10.16 ± 0.55 eV
LUMO Energy -0.98 ± eV
Point Group Symmetry C1
Synonyms
  • 3-(4-chlorophenyl)-3-keto-propionic acid ethyl ester
  • 3-(4-chlorophenyl)-3-oxopropanoic acid ethyl ester
  • benzenepropanoic acid, 4-chloro-beta-oxo-, ethyl ester
  • ehtyl p-chlorobenzoylacetate
  • ethyl (4-chlorobenzoyl)acetate
CAS Number(s)
  • 2881-63-2
InChIKey DGCZHKABHPDNCC-UHFFFAOYSA-N
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Elements H C O Cl