CAS 2445-77-4: 2-Methylbutyl isovalerate

Description: 2-Methylbutyl isovalerate, with the CAS number 2445-77-4, is an ester formed from the reaction of isovaleric acid and 2-methylbutanol. This compound typically exhibits a fruity odor, which makes it useful in flavoring and fragrance applications. It is a colorless to pale yellow liquid at room temperature and is characterized by its relatively low volatility and moderate solubility in organic solvents. The molecular structure features a branched alkyl chain, contributing to its unique sensory properties. In terms of chemical stability, 2-methylbutyl isovalerate is generally stable under normal conditions but may undergo hydrolysis in the presence of strong acids or bases. Its boiling point and melting point are consistent with those of similar esters, indicating a moderate range of thermal stability. Safety data suggests that, while it may cause irritation upon contact with skin or eyes, it is not classified as highly hazardous. Overall, 2-methylbutyl isovalerate is valued in the food and cosmetic industries for its pleasant aroma and flavor profile.

Formula: C₁₀H₂₀O₂

InChI: InChI=1S/C10H20O2/c1-5-9(4)7-12-10(11)6-8(2)3/h8-9H,5-7H2,1-4H3

InChI key: InChIKey=CYGPPWVXOWCHJB-UHFFFAOYSA-N

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

Synonyms:

• 2-Methylbutyl 3-methylbutyrate
• Butanoic acid, 3-methyl-, 2-methylbutyl ester
• Isovaleric acid, 2-methylbutyl ester
• Isovaleric acid, 2-methylbutyl ester
• 2-Methylbutyl isovalerate
• 3-Methylbutanoic acid, 2-methylbutyl ester
• 2-Methylbutyl isovalerianate
• 3-Methylbutyric acid 2-methylbutyl ester
• 2-Methylbutyl 3-methylbutanoate
• 2-Methylbutyl isopentanoate
• Natural 2-Methylbutyl Isovalerate

2-Methylbutyl isovalerate

CAS: 2445-77-4

• Formula: C₁₀H₂₀O₂
• Molecular weight: 172.2646

2-Methylbutyl Isovalerate

CAS: 2445-77-4

• Purity: 98%
• Molecular weight: 172.27g/mol

2-Methylbutyl Isovalerate

CAS: 2445-77-4

• Formula: C₁₀H₂₀O₂
• Purity: >98.0%(GC)
• Color and Shape: Colorless to Almost colorlessclear liquid
• Molecular weight: 172.27

Butanoic acid, 3-methyl-, 2-methylbutyl ester

CAS: 2445-77-4

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• Formula: C₁₀H₂₀O₂
• Purity: Min. 95%
• Molecular weight: 172.26 g/mol