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CAS 41051-20-1

:

1-Methylethyl 4-chloro-3-oxobutanoate

Description:
1-Methylethyl 4-chloro-3-oxobutanoate, with the CAS number 41051-20-1, is an organic compound characterized by its ester functional group and a chloro substituent. This compound typically features a butanoate backbone, which includes a ketone group at the 3-position and a chlorine atom at the 4-position. The presence of the methylethyl group contributes to its unique reactivity and physical properties. Generally, compounds of this nature may exhibit moderate solubility in organic solvents and limited solubility in water due to their hydrophobic characteristics. The chloro substituent can influence the compound's reactivity, making it a potential candidate for various chemical reactions, including nucleophilic substitutions. Additionally, the compound may have applications in organic synthesis, particularly in the production of pharmaceuticals or agrochemicals. As with many organic compounds, safety precautions should be taken when handling it, as it may pose health risks or environmental hazards. Always refer to safety data sheets for specific handling and disposal guidelines.
Formula:C7H11ClO3
InChI:InChI=1S/C7H11ClO3/c1-5(2)11-7(10)3-6(9)4-8/h5H,3-4H2,1-2H3
InChI key:InChIKey=GSNGPDOWIOPXDR-UHFFFAOYSA-N
SMILES:C(CC(CCl)=O)(OC(C)C)=O
Synonyms:
  • 1-Methylethyl 4-chloro-3-oxobutanoate
  • 4-Chloro-3-oxobutyric acid isopropyl ester
  • 4-Chloroacetoacetic acid isopropyl ester
  • Butanoic acid, 4-chloro-3-oxo-, 1-methylethyl ester
  • Isopropyl 4-chloro-3-oxobutanoate
  • Isopropyl γ-chloroacetoacetate
  • Isopropyl 4-chloroacetoacetate
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