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Isobutyl phenylacetate

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Identification
Molecular formula
C12H16O2
CAS number
102-13-6
IUPAC name
(1,1-dimethyl-2-phenyl-ethyl) butanoate
State
State

It is a liquid at room temperature.

Melting point (Celsius)
-36.50
Melting point (Kelvin)
236.70
Boiling point (Celsius)
254.50
Boiling point (Kelvin)
527.70
General information
Molecular weight
206.28g/mol
Molar mass
206.2820g/mol
Density
1.0010g/cm3
Appearence

Isobutyl phenylacetate appears as a clear colorless liquid.

Comment on solubility

Solubility of (1,1-dimethyl-2-phenyl-ethyl) butanoate

(1,1-dimethyl-2-phenyl-ethyl) butanoate is an organic compound known for its interesting solubility characteristics. Understanding solubility is crucial for applications in various fields, including pharmaceuticals and materials science. Here are some key points to consider:

  • Polar vs Non-Polar Solubility: The solubility of this compound can be largely influenced by the presence of non-polar groups within its structure. The presence of the phenyl and alkyl groups suggests it may exhibit non-polar behavior.
  • Solvent Compatibility: Given its structure, (1,1-dimethyl-2-phenyl-ethyl) butanoate is likely to be soluble in non-polar solvents such as hexane and chloroform, but may show limited solubility in polar solvents like water.
  • Temperature Dependency: Solubility is also temperature-dependent. As a rule of thumb, most organic compounds have increased solubility at higher temperatures, which could be applicable to this compound.
  • Specific Uses: Due to its solubility properties, (1,1-dimethyl-2-phenyl-ethyl) butanoate is frequently utilized in formulations where specific solvent compatibility is essential.

In conclusion, the solubility behavior of (1,1-dimethyl-2-phenyl-ethyl) butanoate demonstrates the importance of structural features in determining solubility in various solvents. As expressed in chemical literature, "like dissolves like," highlighting the necessity to consider both polarity and chemical structure when forecasting solubility.

Interesting facts

Interesting Facts about (1,1-Dimethyl-2-phenyl-ethyl) Butanoate

(1,1-Dimethyl-2-phenyl-ethyl) butanoate is a fascinating compound with remarkable applications and properties, making it an interesting subject of study in organic chemistry. Here are some key highlights:

  • Complex Structure: The compound features a unique molecular architecture that incorporates both a butanoate group and an aromatic phenyl ring. This structural complexity aids in its various chemical behaviors.
  • Flavoring Agent: Many esters, including this one, are known for their aromatic qualities. The fruity and floral notes associated with esters make them popular in the food and fragrance industries.
  • Stylistic Diversity: The presence of the dimethyl and phenyl substitutions allows for a wide range of functionalization opportunities, which can lead to derivative compounds with significantly different properties.
  • Application in Synthesis: This compound can be utilized as a key intermediate in organic synthesis, facilitating the formation of more complex molecules in pharmaceutical and medicinal chemistry.
  • Potential Applications: Apart from its use in flavors and fragrances, research indicates that some esters might exhibit biological activity, opening avenues for new medicinal applications.

As one dives deeper into the study of (1,1-dimethyl-2-phenyl-ethyl) butanoate, it becomes clear that its multifunctional nature reflects the intricate relationship between structure and function in organic compounds. In the words of a famous chemist, “Everything is the result of the interplay of chemical behavior.” This compound is an excellent example of that principle, showcasing the vast potential inherent in organic chemistry.

Synonyms
10094-34-5
Butanoic acid, 1,1-dimethyl-2-phenylethyl ester
Benzyldimethylcarbinyl butyrate
Dimethylbenzylcarbinyl butyrate
Dimethyl benzyl carbinyl butyrate
alpha,alpha-Dimethylphenethyl butyrate
Dmbc butyrate
1,1-Dimethyl-2-phenylethyl butyrate
2-Benzyl-2-propyl butyrate
Benzyl dimethylcarbinyl butyrate
1,1-Dimethyl-2-phenylethyl butanoate
Benzyl dimethylcarbinyl n-butyrate
FEMA No. 2394
Benzyl dimethyl carbinyl butyrate
EINECS 233-221-8
DTXSID5038830
Butyric acid, .alpha.,.alpha.-dimethylphenethyl ester
BUTYRIC ACID, alpha,alpha-DIMETHYLPHENETHYL ESTER
DIMETHYL PHENETHYL BUTYRATE
3Q0C60547R
.alpha.,.alpha.-Dimethylphenethyl butyrate
DTXCID3018830
DIMETHYL BENZYL CARBINYL BUTYRATE [FCC]
.ALPHA.,.ALPHA.-DIMETHYLPHENETHYL BUTYRATE [FHFI]
DIMETHYL PHENETHYL BUTYRATE [INCI]
233-221-8
(2-methyl-1-phenylpropan-2-yl) butanoate
2-Methyl-1-phenyl-2-propanyl butyrate
2-methyl-1-phenylpropan-2-yl butyrate
Dimethyl benzyl carbinyl n-butyrate
UNII-3Q0C60547R
SCHEMBL273935
CHEMBL3187337
FEMA 2394
CHEBI:185847
Tox21_300643
AKOS015888177
2-methyl-1-phenylpropan-2-yl butanoate
NCGC00248123-01
NCGC00254551-01
AS-76655
CAS-10094-34-5
CS-0439723
NS00012263
alpha,alpha-Dimethylphenethyl alcohol, butyrate
E79161
.alpha.,.alpha.-Dimethylphenethyl alcohol, butyrate
Q27257883
alpha,alpha-Dimethylphenethyl butyrate, >=95%, FCC, FG