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CAS 3952-67-8

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Methyl 3-methyl-2-oxobutanoate

Description:
Methyl 3-methyl-2-oxobutanoate, with the CAS number 3952-67-8, is an organic compound characterized by its ester functional group and a ketone moiety. It is a colorless to pale yellow liquid with a fruity odor, typical of many esters. This compound features a branched alkyl chain, which contributes to its unique chemical properties and reactivity. Methyl 3-methyl-2-oxobutanoate is soluble in organic solvents such as ethanol and ether but has limited solubility in water due to its hydrophobic alkyl groups. It is often used in organic synthesis and may serve as an intermediate in the production of various pharmaceuticals and agrochemicals. The compound's structure allows for participation in various chemical reactions, including nucleophilic additions and condensation reactions. Safety data indicates that, like many organic solvents, it should be handled with care, as it may pose health risks if inhaled or ingested. Proper safety measures, including the use of personal protective equipment, are recommended when working with this substance.
Formula:C6H10O3
InChI:InChI=1/C6H10O3/c1-4(2)5(7)6(8)9-3/h4H,1-3H3
InChI key:InChIKey=NKWVBPZZQFOVCE-UHFFFAOYSA-N
SMILES:C(C(OC)=O)(C(C)C)=O
Synonyms:
  • Butanoic acid, 3-methyl-2-oxo-, methyl ester
  • Butyric acid, 3-methyl-2-oxo-, methyl ester
  • Methyl 2-oxo-3-methylbutyrate
  • Methyl 2-oxoisovalerate
  • Methyl 3-methyl-2-oxobutyrate
  • Methyl 3-methyl-2-oxobutanoate
  • 2-Oxo-3-methylbutyric acid methyl ester
  • 3-methyl-2-oxobutanoic acid methyl ester
  • 3-Methyl-2-oxobutyric acid methyl ester
  • 2-keto-3-methyl-butyric acid methyl ester
  • MFCD12198846
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