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Isobutyl hexanoate

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Identification
Molecular formula
C10H20O2
CAS number
123-92-2
IUPAC name
isobutyl hexanoate
State
State

Isobutyl hexanoate is a liquid at room temperature. It is commonly stored in sealed containers to prevent evaporation and maintain its aromatic qualities.

Melting point (Celsius)
-45.00
Melting point (Kelvin)
228.15
Boiling point (Celsius)
186.80
Boiling point (Kelvin)
459.95
General information
Molecular weight
158.24g/mol
Molar mass
158.2420g/mol
Density
0.8716g/cm3
Appearence

Isobutyl hexanoate is a colorless liquid with a fruity odor, often associated with the smell of apples or pineapple. It has an oily texture and is commonly used in the fragrance industry and in flavoring applications.

Comment on solubility

Solubility of Isobutyl Hexanoate

Isobutyl hexanoate, with the chemical formula C11H22O2, is an ester formed from isobutyl alcohol and hexanoic acid. Understanding its solubility characteristics is essential for various applications in the chemical and food industries.

General Solubility Properties

  • Polar vs. Nonpolar: Isobutyl hexanoate is classified as a nonpolar molecule. This significantly impacts its solubility in different solvents.
  • Solvent Interaction: It tends to be highly soluble in organic solvents such as hexane and ethanol, while exhibiting low solubility in polar solvents like water.
  • Temperature Dependency: Its solubility can also depend on temperature; typically, an increase in temperature enhances the solubility of organic compounds in organic solvents.

In practical terms, this means:

  • Isobutyl hexanoate is effectively used in fragrances and flavorings due to its ability to blend well with other nonpolar aromatic compounds.
  • For applications in aqueous environments, the low solubility in water suggests that it may require emulsification or specific formulations to stabilize mixtures.

In summary, the solubility of isobutyl hexanoate showcases the importance of understanding molecular interactions and solvation dynamics, paving the way for innovative applications in various chemical processes.

Interesting facts

Interesting Facts About Isobutyl Hexanoate

Isobutyl hexanoate is an intriguing compound that's part of the ester family, known for its unique properties and applications. Here are some engaging facts that highlight its significance in various fields:

  • Flavor and Fragrance: This compound is widely used as a flavoring agent in the food industry. It has a fruity aroma reminiscent of apple or pineapple, making it popular in candies, beverages, and baked goods.
  • Natural Occurrence: Isobutyl hexanoate can be found in nature, particularly in the fermentation of certain fruits, which adds a natural appeal to its synthetic versions used in the food industry.
  • Industrial Applications: Beyond the realm of food and beverages, isobutyl hexanoate plays a role in the production of perfumes and cosmetics due to its pleasant scent. It's also utilized in the synthesis of other chemical compounds.
  • Solvent Properties: This ester serves as an effective solvent in various chemical reactions, aiding in the dissolution of organic compounds, which is invaluable in both industrial processes and laboratory settings.
  • Research and Development: Scientists are continually exploring the ester's potential applications, ranging from improving food product quality to enhancing sustainability in chemical processes.

As noted in the words of renowned chemist Linus Pauling, "The science of chemistry is more than a mere compilation of facts; it is a study of nature's principles." Isobutyl hexanoate exemplifies this by bridging natural flavors and industrial utility, making it a fascinating subject of study for those interested in both chemistry and food science.

Synonyms
Isobutyl hexanoate
105-79-3
Isobutyl caproate
2-METHYLPROPYL HEXANOATE
Hexanoic acid, 2-methylpropyl ester
Hexanoic acid, isobutyl ester
FEMA No. 2202
Isobutyl caproate (natural)
2-Methyl-1-propyl caproate
n-Caproic acid isobutyl ester
EINECS 203-332-6
UNII-2A3X4W9GZ0
2A3X4W9GZ0
iso-Butyl n-hexanoate
AI3-24254
DTXSID0059322
ISOBUTYL HEXANOATE [FCC]
CHEBI:87421
FEMA 2202
ISOBUTYL HEXANOATE [FHFI]
Hexanoic Acid Isobutyl Ester
Isobutylhexanoate
MFCD00048870
Isobutyl caproic acid
2-Methylpropyl hexanoic acid
SCHEMBL129293
Hexanoate 2-methylpropyl ester
CHEMBL4647902
DTXCID3032919
hexanoic acid 2-methylpropyl ester
Isobutyl hexanoate, >=98%, FG
LMFA07010729
Isobutyl hexanoate, natural, >=95%
AKOS015904122
CS-W010767
AS-75504
H0110
NS00012679
Q27159615
203-332-6