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CAS 5870-68-8

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Ethyl 3-methylpentanoate

Description:
Ethyl 3-methylpentanoate is an ester that belongs to the class of carboxylic acid derivatives. It is formed from the reaction of 3-methylpentanoic acid and ethanol. This compound typically appears as a colorless to pale yellow liquid with a fruity odor, making it useful in flavoring and fragrance applications. Ethyl 3-methylpentanoate has a moderate boiling point and is relatively soluble in organic solvents, while being less soluble in water due to its hydrophobic nature. Its molecular structure features a five-carbon chain with a branched methyl group, contributing to its unique properties. The compound is generally stable under standard conditions but may undergo hydrolysis in the presence of strong acids or bases. Ethyl 3-methylpentanoate is often used in organic synthesis and can serve as a building block for more complex molecules. Safety data indicates that it should be handled with care, as it may cause irritation to the skin and eyes. Proper storage in a cool, well-ventilated area is recommended to maintain its integrity.
Formula:C8H16O2
InChI:InChI=1S/C8H16O2/c1-4-7(3)6-8(9)10-5-2/h7H,4-6H2,1-3H3
InChI key:InChIKey=TXAWGHYFBQBVNK-UHFFFAOYSA-N
SMILES:C(C(OCC)=O)C(CC)C
Synonyms:
  • 3-Methylvaleric acid ethyl ester
  • Ethyl 3-methylvalerate
  • Ethyl β-methylvalerate
  • Pentanoic acid, 3-methyl-, ethyl ester
  • Valeric acid, 3-methyl-, ethyl ester
  • Ethyl 3-methylpentanoate
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