CAS 94071-12-2

Butanoic acid, 2-ethyl-, 3-hexenyl ester, (Z)-

Description:

Butanoic acid, 2-ethyl-, 3-hexenyl ester, (Z)-, with the CAS number 94071-12-2, is an organic compound characterized by its ester functional group, which is formed from the reaction of butanoic acid and a specific alcohol. This compound features a butanoic acid moiety, indicating a four-carbon carboxylic acid structure, and is further modified by the presence of a 2-ethyl group and a 3-hexenyl chain, contributing to its unique properties. The "(Z)-" designation refers to the stereochemistry of the double bond in the hexenyl portion, indicating that the substituents are on the same side, which can influence the compound's reactivity and physical properties. Generally, esters like this one are known for their pleasant odors and are often used in flavoring and fragrance applications. Additionally, they may exhibit varying degrees of solubility in water and organic solvents, depending on their molecular structure. The compound's specific characteristics, such as boiling point, melting point, and reactivity, would require further empirical data for precise determination.

Formula: C₁₂H₂₂O₂

InChI: InChI=1/C12H22O2/c1-4-7-8-9-10-14-12(13)11(5-2)6-3/h7-8,11H,4-6,9-10H2,1-3H3/b8-7+

InChI key: InChIKey=LFDWLVXNYKQQBT-FPLPWBNLSA-N

SMILES: C(C(OCC/C=C\CC)=O)(CC)CC

Synonyms:

• (3E)-hex-3-en-1-yl 2-ethylbutanoate
• Butanoic acid, 2-ethyl-, 3-hexenyl ester, (Z)-
• cis-3-Hexen-1-yl 2-ethylbutanoate
• (Z)-Hex-3-enyl 2-ethylbutyrate
• 2-Ethylbutanoic acid (Z)-3-hexenyl ester
• Butanoic acid, 2-ethyl-, 3-hexenyl ester, (Z)- (9CI)
• 2-Ethylbutyric acid (Z)-3-hexenyl ester
• (Z)-3-hexen-1-yl 2-ethyl butyrate