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CAS 2351-89-5

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2-Hexenoic acid, 5-methyl-, ethyl ester

Description:
2-Hexenoic acid, 5-methyl-, ethyl ester, with the CAS number 2351-89-5, is an organic compound classified as an ester. It is derived from the reaction of 2-hexenoic acid and ethanol. This compound typically appears as a colorless to pale yellow liquid with a characteristic fruity odor, which is common among esters. Its molecular structure features a double bond in the hexenoic acid chain, contributing to its reactivity and potential applications in organic synthesis. The presence of the methyl group at the fifth carbon position influences its physical and chemical properties, such as boiling point and solubility. 2-Hexenoic acid, 5-methyl-, ethyl ester is often utilized in the fragrance and flavor industry due to its pleasant aroma, and it may also find applications in the production of various chemical intermediates. As with many esters, it is generally less polar than its corresponding acids, affecting its solubility in different solvents. Safety data should be consulted for handling and exposure guidelines, as with any chemical substance.
Formula:C9H16O2
InChI:InChI=1/C9H16O2/c1-4-11-9(10)7-5-6-8(2)3/h5,7-8H,4,6H2,1-3H3/b7-5+
InChI key:InChIKey=XBRGZVMBYLXWTE-UHFFFAOYSA-N
SMILES:C(C=CCC(C)C)(OCC)=O
Synonyms:
  • 2-Hexenoic acid, 5-methyl-, ethyl ester
  • 5-Methylhex-2-enoic acid ethyl ester
  • ethyl (2E)-5-methylhex-2-enoate
  • Ethyl 5-methylhex-2-enoate
  • Einecs 219-086-8
  • Ethyl 5-methyl-2-hexenoate
  • 5-Methyl-2-hexenoic acid ethyl ester
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