CAS 30982-02-6

Octanoic acid, 2-methyl-, ethyl ester

Description:

Octanoic acid, 2-methyl-, ethyl ester, also known as ethyl 2-methylcaprylate, is an ester derived from the reaction of 2-methyl-octanoic acid and ethanol. It typically appears as a colorless to pale yellow liquid with a fruity odor, characteristic of many esters. This compound is soluble in organic solvents and has limited solubility in water due to its hydrophobic octyl chain. It is known for its use in flavoring and fragrance applications, contributing to the aroma of various food products. Additionally, it may be utilized in the synthesis of other chemical compounds and as an intermediate in organic chemistry. The compound's molecular structure includes a long hydrophobic tail, which influences its physical properties, such as boiling point and volatility. Safety data indicates that, like many esters, it should be handled with care, as it may cause irritation upon contact with skin or eyes. Proper storage in a cool, dry place away from strong oxidizers is recommended to maintain its stability.

Formula: C₁₁H₂₂O₂

InChI: InChI=1S/C11H22O2/c1-4-6-7-8-9-10(3)11(12)13-5-2/h10H,4-9H2,1-3H3

InChI key: InChIKey=HRJHQOXWONBAJC-UHFFFAOYSA-N

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

Synonyms:

• Octanoic acid, 2-methyl-, ethyl ester
• Ethyl α-methyloctanoate
• 2-Methyloctanoic acid ethyl ester
• Ethyl 2-methyloctanoate

Ethyl 2-methyloctanoate

CAS: 30982-02-6

Formula: C₁₁H₂₂O₂

Molecular weight: 186.2912

Ref: IN-DA0031UA