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CAS 610-89-9

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Ethyl 2-allylacetoacetate

Description:
Ethyl 2-allylacetoacetate, with the CAS number 610-89-9, is an organic compound that belongs to the class of esters. It is characterized by its molecular structure, which includes an ethyl group, an allyl group, and a keto-acid moiety. This compound typically appears as a colorless to pale yellow liquid with a fruity odor. Ethyl 2-allylacetoacetate is known for its reactivity, particularly in organic synthesis, where it can participate in various chemical reactions such as Michael additions and Claisen condensations. It is soluble in organic solvents like ethanol and ether but has limited solubility in water. The compound is often utilized in the synthesis of more complex organic molecules and can serve as an intermediate in the production of pharmaceuticals and agrochemicals. Safety data indicates that it should be handled with care, as it may pose health risks if inhaled or ingested, and appropriate safety measures should be taken during its use in laboratory or industrial settings.
Formula:C9H14O3
InChI:InChI=1S/C9H14O3/c1-4-6-8(7(3)10)9(11)12-5-2/h4,8H,1,5-6H2,2-3H3
InChI key:InChIKey=IXKFNTFJUHTDNE-UHFFFAOYSA-N
SMILES:C(C(OCC)=O)(CC=C)C(C)=O
Synonyms:
  • 2-Acetyl-pent-4-enoic acid ethyl ester
  • 4-Pentenoic acid, 2-acetyl-, ethyl ester
  • Ai3-11071
  • Ethyl 2-acetyl-4-pentenoate
  • Ethyl 2-allyl-3-oxobutanoate
  • Ethyl 2-allylacetoacetate
  • Ethyl alpha-allylacetoacetate
  • Ethyl α-allylacetoacetate
  • Nsc 10814
  • ethyl (2S)-2-acetylpent-4-enoate
  • Ethyl 2-acetylpent-4-enoate
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