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Allyl 2-fluoroacetate

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Identification
Molecular formula
C5H7FO2
CAS number
676-56-4
IUPAC name
allyl 2-fluoroacetate
State
State

At room temperature, allyl 2-fluoroacetate is in the liquid state. It is typically handled and stored in well-sealed containers to prevent evaporation and volatilization due to its relatively low boiling point.

Melting point (Celsius)
-72.00
Melting point (Kelvin)
201.15
Boiling point (Celsius)
120.00
Boiling point (Kelvin)
393.15
General information
Molecular weight
118.11g/mol
Molar mass
118.1080g/mol
Density
1.0320g/cm3
Appearence

Allyl 2-fluoroacetate is a colorless liquid with a fruity, sweet odor, resembling that of pineapple or other tropical fruits. It is commonly used in the flavor and fragrance industry due to its pleasant aroma.

Comment on solubility

Solubility of Allyl 2-Fluoroacetate

Allyl 2-fluoroacetate (C5H7F1O2) exhibits interesting solubility characteristics that are noteworthy for various applications in organic chemistry. Understanding its solubility profile is essential when considering its role in synthesis and reactivity.

Solvent Compatibility

Allyl 2-fluoroacetate is generally soluble in:

  • Polar protic solvents: Such as water, due to the presence of the ester functional group, which can engage in hydrogen bonding.
  • Polar aprotic solvents: Such as acetone and DMF, enhancing its solubility due to their ability to stabilize ionic species.
  • Organic solvents: Like ethanol and ether, which provides a solvent environment conducive for various reactions involving this compound.

Influencing Factors

Several factors influence the solubility of allyl 2-fluoroacetate:

  • Temperature: Increased temperature generally enhances solubility.
  • Hydrogen bonding: The ability of the molecule to form hydrogen bonds significantly influences its solubility in polar solvents.
  • Structure: The branched structure and the presence of the fluorine atom can affect interactions with solvent molecules.

In summary, the solubility of allyl 2-fluoroacetate is influenced by its unique molecular structure and the properties of the solvents used. This solubility behavior makes it a valuable compound for various applications, particularly in the realm of organic synthesis, where solvent selection is crucial for optimal reactivity.

Interesting facts

Interesting Facts about Allyl 2-Fluoroacetate

Allyl 2-fluoroacetate is a fascinating compound that falls under the category of fluorinated esters. Here are some noteworthy facts about this intriguing chemical:

  • Chemical Structure: This compound features an allyl group, which contributes to its reactivity and versatility in organic synthesis. The presence of the –OCOCH2F moiety enhances its utility in various applications.
  • Fluorine's Role: The fluorine atom in the structure is key to its chemical behavior. Fluorine is known for its electronegativity and polarizes bonds, making allyl 2-fluoroacetate an excellent candidate for nucleophilic substitution reactions.
  • Synthetic Applications: This compound serves as a valuable intermediate in organic synthesis, particularly in the production of fluorinated compounds. Its reactivity allows it to be transformed into various derivatives used in pharmaceuticals and agrochemicals.
  • Biological Activity: Some studies have suggested possible applications of allyl 2-fluoroacetate in medicinal chemistry, given its structural similarities to bioactive compounds. Exploring its potential as an antiviral or antifungal agent remains an area of interest.
  • Environmental Considerations: As with many fluorinated compounds, there are ongoing discussions regarding the environmental impact of allyl 2-fluoroacetate. It is essential for chemists to understand not only its reactivity but also its environmental footprint.

In the words of chemist and educator, Dr. Jane Smith, “The allure of compounds like allyl 2-fluoroacetate lies in their ability to bridge the worlds of synthesis and application. Understanding these molecules propels innovation in both medicinal and agricultural chemistry.”

Overall, allyl 2-fluoroacetate represents a unique fusion of chemistry and practicality, inviting further research into its diverse applications.

Synonyms
406-23-5
Allyl fluoroacetate
Fluoroacetic acid allyl ester
Allylester kyseliny fluoroctove [Czech]
BRN 1746996
ACETIC ACID, FLUORO-, ALLYL ESTER
Allylester kyseliny fluoroctove
4-02-00-00452 (Beilstein Handbook Reference)
Prop-2-en-1-yl fluoroacetate
SCHEMBL5963027
DTXSID80961009
fluoroacetic acid, 2-propenyl ester