Ethyl (2S)-2-Chloro-3-Oxobutanoate

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Properties Simple | Detailed

Formula C6H9ClO3
IUPAC Name ethyl (2s)-2-chloro-3-oxo-butanoate
Molecular Mass 164.587 g·mol−1
Heat of Formation -608.5 ± 16.7 kJ·mol−1
Dipole Moment 4.40 ± 1.08 D
Volume 186.08 Å 3
Surface Area 188.21 Å 2
HOMO Energy -10.62 ± 0.55 eV
LUMO Energy 2.59 ± eV
Point Group Symmetry C1
Synonyms
  • (2s)-2-chloro-3-keto-butyric acid ethyl ester
  • (2s)-2-chloro-3-oxobutanoic acid ethyl ester
  • ethyl (2s)-2-chloro-3-oxo-butanoate
InChIKey RDULEYWUGKOCMR-YFKPBYRVSA-N
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Elements H C O Cl