CAS 53398-85-9: cis-3-Hexenyl 2-methylbutanoate

Description: Cis-3-Hexenyl 2-methylbutanoate, with the CAS number 53398-85-9, is an organic compound classified as an ester. It is formed from the reaction of cis-3-hexenal and 2-methylbutanoic acid. This compound is characterized by its fruity and green odor, which is often associated with fresh-cut grass and various fruits, making it a valuable ingredient in the flavor and fragrance industries. It is typically a colorless to pale yellow liquid at room temperature and is soluble in organic solvents. The molecular structure features a hexenyl group, contributing to its reactivity and sensory properties. Due to its pleasant aroma, cis-3-Hexenyl 2-methylbutanoate is commonly used in perfumes, cosmetics, and food flavorings. Additionally, it may exhibit some degree of volatility, which can influence its application in various formulations. As with many esters, it may also undergo hydrolysis under certain conditions, leading to the release of the corresponding alcohol and acid.

Formula: C₁₁H₂₀O₂

InChI: InChI=1/C11H20O2/c1-4-6-7-8-9-13-11(12)10(3)5-2/h6-7,10H,4-5,8-9H2,1-3H3/b7-6-

InChI key: InChIKey=JKKGTSUICJWEKB-SREVYHEPNA-N

SMILES: O=C(OCCC=CCC)C(C)CC

Synonyms:

• cis-3-Hexenyl 2-methylbutyrate
• (Z)-3-Hexenyl 2-methylbutyrate
• Butanoic acid, 2-methyl-, (3Z)-3-hexen-1-yl ester
• Butanoic acid, 2-methyl-, 3-hexenyl ester, (Z)-
• Butanoic acid, 2-methyl-, (3Z)-3-hexenyl ester

cis-3-Hexen-1-yl 2-Methylbutyrate

CAS: 53398-85-9

• Formula: C₁₁H₂₀O₂
• Purity: >97.0%(GC)
• Color and Shape: Colorless to Almost colorless clear liquid
• Molecular weight: 184.28

(Z)-Hex-3-en-1-yl 2-methylbutanoate

CAS: 53398-85-9

• Formula: C₁₁H₂₀O₂
• Purity: 97%
• Color and Shape: Liquid
• Molecular weight: 184.2753

Cis-3-Hexenyl 2-Methylbutanoate

CAS: 53398-85-9

• Purity: 98%+
• Molecular weight: 184.28g/mol

(Z)-Hex-3-en-1-yl 2-methylbutanoate

CAS: 53398-85-9

• Purity: 97.0%
• Color and Shape: Liquid, Oil
• Molecular weight: 184.2790069580078

cis-3-Hexen-1-yl 2-Methylbutyrate

CAS: 53398-85-9

cis-3-Hexen-1-yl 2-Methylbutyrate is a natural product that is found in cruciferous vegetables. It has been …

• Formula: C₁₁H₂₀O₂
• Purity: Min. 95%
• Molecular weight: 184.28 g/mol