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CAS 818-58-6

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Methyl 3-pentenoate

Description:
Methyl 3-pentenoate, with the CAS number 818-58-6, is an ester that belongs to the family of unsaturated carboxylic acid derivatives. It is characterized by its molecular formula, which typically includes carbon, hydrogen, and oxygen atoms, reflecting its structure as an ester formed from methanol and 3-pentenoic acid. This compound is a colorless to pale yellow liquid with a fruity odor, making it of interest in flavor and fragrance applications. Methyl 3-pentenoate is known for its reactivity due to the presence of a double bond in the pentenoate chain, which can participate in various chemical reactions, including polymerization and addition reactions. It is soluble in organic solvents but has limited solubility in water. The compound is used in organic synthesis and may serve as an intermediate in the production of other chemicals. Safety data indicates that, like many esters, it should be handled with care, as it may cause irritation upon contact with skin or eyes.
Formula:C6H10O2
InChI:InChI=1S/C6H10O2/c1-3-4-5-6(7)8-2/h3-4H,5H2,1-2H3
InChI key:InChIKey=KJALUUCEMMPKAC-UHFFFAOYSA-N
SMILES:C(CC=CC)(OC)=O
Synonyms:
  • 3-Pentenoic acid, methyl ester
  • Methyl 3-pentenoate
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