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[2-fluoro-1-(fluoromethyl)ethyl] benzenesulfonate

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Identification
Molecular formula
C9H9F2O3S
CAS number
18629-11-7
IUPAC name
[2-fluoro-1-(fluoromethyl)ethyl] benzenesulfonate
State
State

At room temperature, this compound remains in a liquid state. It is a stable substance under normal conditions but should still be handled with care due to its reactive sulfonate group.

Melting point (Celsius)
-20.00
Melting point (Kelvin)
253.10
Boiling point (Celsius)
235.80
Boiling point (Kelvin)
509.00
General information
Molecular weight
236.22g/mol
Molar mass
236.2240g/mol
Density
1.3379g/cm3
Appearence

The compound is generally observed as a colorless liquid, which demonstrates clarity and lacks any visible impurities when pure. Its appearance is typical for organic sulfonate esters.

Comment on solubility

Solubility of [2-fluoro-1-(fluoromethyl)ethyl] benzenesulfonate

The solubility of [2-fluoro-1-(fluoromethyl)ethyl] benzenesulfonate is influenced by several factors due to its unique structural characteristics. This compound contains both a fluorinated moiety and a sulfonate group, which tend to exhibit distinct solvation behavior:

  • Polarity: The sulfonate group (-SO3-) is highly polar, which generally enhances solubility in polar solvents such as water.
  • Fluorinated moiety: The presence of fluorine atoms tends to increase lipophilicity, potentially reducing solubility in polar solvents and favoring solubility in non-polar solvents.
  • Interactions: Strong interactions such as hydrogen bonding and dipole-dipole interactions with the solvent can play a significant role in determining solubility.

In conclusion, the overall solubility of [2-fluoro-1-(fluoromethyl)ethyl] benzenesulfonate may vary widely depending on the solvent used, highlighting the importance of considering both polar and non-polar characteristics when predicting solubility. It is also noteworthy to mention that this compound could exhibit different solubility profiles at varying temperatures.

Interesting facts

Interesting Facts about [2-fluoro-1-(fluoromethyl)ethyl] benzenesulfonate

[2-fluoro-1-(fluoromethyl)ethyl] benzenesulfonate is a fascinating compound that stands out in the field of organic chemistry due to its unique structural characteristics and applications. Here are some engaging insights into this compound:

  • Substituent Diversity: The presence of fluorine in its structure adds unique properties, such as increased electronegativity and altered reactivity. This makes it an interesting subject for studying electronic effects and molecular interactions.
  • Applications in Synthesis: This compound can serve as a valuable intermediate in the synthesis of pharmaceuticals and agrochemicals. The versatility of benzenesulfonate groups is often leveraged in various organic reactions, such as nucleophilic substitutions.
  • Reactivity Studies: Compounds containing the sulfonate group are known for their reactivity with nucleophiles. [2-fluoro-1-(fluoromethyl)ethyl] benzenesulfonate offers researchers insights into understanding reaction mechanisms and kinetics in organic reactions.
  • Chemotherapeutic Potential: The halogenated moieties in compounds like this one are known to exhibit biological activity, making them candidates for drug design. Fluorinated compounds are often more stable and can enhance the pharmacokinetic properties of drug candidates.

As scientists continue to explore the realm of organofluorine chemistry, compounds like [2-fluoro-1-(fluoromethyl)ethyl] benzenesulfonate not only expand our understanding of chemical interactions but also pave the way for innovative applications. The synergy between fluorine substitution and sulfonate groups could lead to the discovery of novel materials and therapeutic agents.

In summary, this compound is a remarkable subject of study, offering a blend of chemical complexity and practical relevance that can inspire new avenues for research and development in various scientific fields.

Synonyms
1,3-DIFLUORO-2-PROPANOL BENZENESULFONATE
882-71-3
DTXSID20236889