Draw The Structure For 2 4 6 Trimethylphenol – In the realm of chemistry, understanding the structure of compounds is paramount. One such compound, 2,4,6-trimethylphenol, presents a fascinating case study. Its unique molecular arrangement and diverse applications make it a subject of great interest. This article delves into the structural formula, physical and chemical properties, synthesis, applications, spectroscopic characterization, biological activity, and toxicity of 2,4,6-trimethylphenol, providing a comprehensive overview of this versatile compound.
Tabela de Conteúdo
- Physical and Chemical Properties
- Reactivity
- Solubility
- Stability
- Synthesis and Applications
- Kolbe-Schmitt Reaction
- Alkylation of Phenol, Draw The Structure For 2 4 6 Trimethylphenol
- Antioxidants
- Fragrances and Flavors
- Pharmaceuticals
- Spectroscopic Characterization
- Infrared Spectroscopy (IR)
- Nuclear Magnetic Resonance (NMR) Spectroscopy
- Mass Spectrometry (MS)
- Concluding Remarks: Draw The Structure For 2 4 6 Trimethylphenol
Physical and Chemical Properties
,4,6-Trimethylphenol is a white to light yellow solid with a characteristic phenolic odor. It has a melting point of 57-59 °C and a boiling point of 218-220 °C. 2,4,6-Trimethylphenol is slightly soluble in water and more soluble in organic solvents such as ethanol, ether, and benzene.Chemically,
The chemical structure of 2,4,6-trimethylphenol can be drawn using various software programs. The three methyl groups are attached to the benzene ring at the 2, 4, and 6 positions, resulting in a symmetrical molecule. Understanding the structure of organic compounds like 2,4,6-trimethylphenol is essential for studying their reactivity and properties.
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2,4,6-Trimethylphenol is a relatively stable compound. It is resistant to oxidation and hydrolysis. However, it is reactive towards electrophilic aromatic substitution reactions.
Reactivity
,4,6-Trimethylphenol is a reactive compound that can undergo a variety of electrophilic aromatic substitution reactions. These reactions include nitration, sulfonation, halogenation, and alkylation. The methyl groups on the phenol ring activate the ring towards electrophilic attack.
Solubility
,4,6-Trimethylphenol is slightly soluble in water and more soluble in organic solvents. The solubility of 2,4,6-trimethylphenol in water is due to the presence of the hydroxyl group, which can form hydrogen bonds with water molecules. The solubility of 2,4,6-trimethylphenol in organic solvents is due to the nonpolar nature of the methyl groups.
Stability
,4,6-Trimethylphenol is a relatively stable compound. It is resistant to oxidation and hydrolysis. However, it is reactive towards electrophilic aromatic substitution reactions.
Synthesis and Applications
2,4,6-Trimethylphenol is a versatile chemical compound with various industrial applications. Its synthesis involves several methods, including:
Kolbe-Schmitt Reaction
- The Kolbe-Schmitt reaction involves the reaction of 2,4,6-trimethylphenol with carbon dioxide and sodium hydroxide under high pressure and temperature.
- This reaction produces salicylic acid, an important intermediate in the production of aspirin and other pharmaceuticals.
Alkylation of Phenol, Draw The Structure For 2 4 6 Trimethylphenol
- Alkylation of phenol with isobutylene in the presence of an acid catalyst yields 2,4,6-trimethylphenol.
- This method is commonly used for large-scale production of 2,4,6-trimethylphenol.
2,4,6-Trimethylphenol finds extensive use in various industries, primarily as an intermediate in the production of:
Antioxidants
- 2,4,6-Trimethylphenol is used as an antioxidant in the production of rubber, plastics, and petroleum products.
- It prevents degradation and extends the shelf life of these materials.
Fragrances and Flavors
- 2,4,6-Trimethylphenol is a key component in the production of fragrances and flavors.
- It contributes to the characteristic scents and tastes of various products.
Pharmaceuticals
- 2,4,6-Trimethylphenol is an intermediate in the synthesis of various pharmaceuticals, including aspirin, ibuprofen, and naproxen.
- These drugs possess analgesic, anti-inflammatory, and antipyretic properties.
Spectroscopic Characterization
,4,6-trimethylphenol can be characterized using various spectroscopic techniques. These techniques provide valuable information about the structure, composition, and bonding of the compound.
Infrared Spectroscopy (IR)
IR spectroscopy measures the absorption of infrared radiation by a sample. The absorption pattern provides information about the functional groups present in the molecule. In the case of 2,4,6-trimethylphenol, the IR spectrum shows characteristic peaks at 3300 cm -1(O-H stretching), 2960 cm -1(C-H stretching), 1610 cm -1(C=C stretching), and 1260 cm -1(C-O stretching).
These peaks confirm the presence of the hydroxyl group, methyl groups, and aromatic ring in the molecule.
Nuclear Magnetic Resonance (NMR) Spectroscopy
NMR spectroscopy provides information about the chemical environment of atoms within a molecule. 1H NMR spectroscopy, in particular, can be used to identify and quantify the different types of hydrogen atoms in 2,4,6-trimethylphenol. The 1H NMR spectrum of the compound shows three distinct peaks at 7.0 ppm (aromatic protons), 2.3 ppm (methyl protons), and 1.2 ppm (hydroxyl proton).
The integration of these peaks confirms the 2:6:1 ratio of aromatic, methyl, and hydroxyl protons, respectively.
Mass Spectrometry (MS)
MS is used to determine the molecular weight and elemental composition of a compound. The mass spectrum of 2,4,6-trimethylphenol shows a molecular ion peak at m/z = 150, which corresponds to the molecular weight of the compound (C 9H 12O).
The spectrum also shows fragment ions at m/z = 122 (loss of a methyl group), m/z = 94 (loss of two methyl groups), and m/z = 66 (loss of the hydroxyl group). These fragment ions provide further confirmation of the structure of the compound.
Concluding Remarks: Draw The Structure For 2 4 6 Trimethylphenol
In summary, 2,4,6-trimethylphenol is a versatile compound with a wide range of applications. Its unique structural features and properties make it a valuable intermediate in the production of other chemicals and a potential candidate for pharmacological applications. Understanding the chemistry of 2,4,6-trimethylphenol is essential for harnessing its full potential in various fields.
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