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Ethyl 4-(4-chloro-2-methylphenoxy)butanoate

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Identification
Molecular formula
C13H17ClO3
CAS number
55981-09-4
IUPAC name
ethyl 4-(4-chloro-2-methyl-phenoxy)butanoate
State
State

At room temperature, ethyl 4-(4-chloro-2-methylphenoxy)butanoate is generally in a liquid state. It is not highly volatile, maintaining its liquid form under typical laboratory conditions.

Melting point (Celsius)
-15.50
Melting point (Kelvin)
257.65
Boiling point (Celsius)
330.20
Boiling point (Kelvin)
603.35
General information
Molecular weight
258.73g/mol
Molar mass
258.7380g/mol
Density
1.1626g/cm3
Appearence

Ethyl 4-(4-chloro-2-methylphenoxy)butanoate is a pale yellow liquid with a slight aromatic odor. It is often characterized by its transparent to slightly cloudy appearance.

Comment on solubility

Solubility of Ethyl 4-(4-chloro-2-methyl-phenoxy)butanoate

The solubility of ethyl 4-(4-chloro-2-methyl-phenoxy)butanoate (C13H17ClO3) can be understood through several factors influencing its behavior in various solvents.

Typically, this compound exhibits the following characteristics:

  • Polar vs. Non-Polar Solvents: Due to the presence of both polar (the ester group) and non-polar (the long hydrocarbon chain) characteristics in its structure, the solubility is expected to be higher in organic solvents such as dichloromethane or ethyl acetate.
  • Water Solubility: This compound is likely to have limited solubility in water. The bulky chloro- and alkyl groups disrupt hydrogen bonding, which is essential for solubility in polar solvents like water.
  • Temperature Dependence: As is common with many organic compounds, increasing the temperature may enhance solubility, allowing for greater molecular interaction in organic solvents.

In summary, ethyl 4-(4-chloro-2-methyl-phenoxy)butanoate is primarily soluble in non-polar organic solvents, highlighting its hydrophobic nature with limited solubility in water. Understanding the solubility dynamics is crucial for practical applications such as formulation and extraction processes.

Interesting facts

Interesting Facts about Ethyl 4-(4-chloro-2-methyl-phenoxy)butanoate

Ethyl 4-(4-chloro-2-methyl-phenoxy)butanoate is a compound that illustrates the fascinating interplay between organic chemistry and practical applications. Here are some intriguing aspects of this compound:

  • Chemical Significance: This compound functions as an ester resulting from the reaction between an alcohol (ethyl alcohol) and a carboxylic acid. The presence of the phenoxy group highlights its potential in the field of organic synthesis.
  • Pesticide Development: Compounds similar to this one have been researched for their effectiveness as herbicides or fungicides. The chloro and methyl substitutions can enhance biochemical interactions, making them candidates for agricultural applications.
  • Role in Medicinal Chemistry: Various derivatives and modifications of esters like this can lead to new pharmacologically active compounds. Investigating the biological activity of this structure can provide insights into potential therapeutic uses.
  • Environmental Impact: Understanding the stability and breakdown of this compound in the environment is crucial. Researchers frequently analyze such esters for their ecological effects and toxicity levels, especially if used in agricultural settings.
  • Synthetic Methods: The synthesis of this compound involves several key reactions, such as nucleophilic substitution and esterification. Mastery of these techniques provides a solid foundation for chemists working in organic synthesis.

In conclusion, ethyl 4-(4-chloro-2-methyl-phenoxy)butanoate exemplifies how small changes in molecular structure can lead to significant variations in activity and application. It embodies the spirit of discovery that drives scientific research and innovation.

Synonyms
10443-70-6
MCPB-ethyl
MCPB ethyl
MCPB ethyl ester
MCPBE
Butanoic acid, 4-(4-chloro-2-methylphenoxy)-, ethyl ester
MCPB-ethyl [ISO]
Ethyl 4-(2-methyl-4-chlorophenoxy)butylate
Butyric acid, 4-((4-chloro-o-tolyl)oxy)-, ethyl ester
DTXSID4058287
DTXCID7032006
600-564-3
MCPB-ethyl ester
Ethyl 4-(4-Chloro-2-methylphenoxy)butyrate
ETHYL 4-(4-CHLORO-2-METHYLPHENOXY)BUTANOATE
4-(4-Chloro-2-methylphenoxy)butyric Acid Ethyl Ester
MFCD00128924
SCHEMBL1613775
XNKARWLGLZGMGX-UHFFFAOYSA-N
KAA44370
AS-82276
CS-0440439
E1149
NS00023305
T71550
4-(4-Chloro-2-methylphenoxy)butyric acid, ethyl ester