What is the chemical structure of Ethyl 2-iodo-5-methylbenzoate?
Ethyl 2-iodo-5-methylbenzoate, the Chinese name for ethyl 2-iodo-5-methylbenzoate, can be deduced in the following way.
First, "benzoate" indicates that this compound is a benzoate, the basic benzoate of benzoic acid is connected to a carboxyl group ($C_6H_5COOH $). "Ethyl" represents ethyl, that is, the carboxyl group ($-OH $) is replaced by ethoxy ($- OCH_2CH_3 $) to form $C_6H_5COOCH_2CH_3 $.
And the substituent on "2-iodo-5-methyl" is described. " 2-Iodo "means that there is an iodine atom ($-I $) substituted at the first position (2-carbon) of the carbon atom of the benzene carboxyl phase (1-carbon);" 5-methyl "means that there is a methyl ($- CH_3 $) substituted at the second position (5-carbon) of 1-carbon.
Therefore, Ethyl 2-iodo-5-methylbenzoate is used: On benzene, 1-carbon is connected to $COOCH_2CH_3, 2-carbon is connected to an iodine atom, and 5-carbon is connected to a methyl group. In the chemical formula, it is approximately $C_9H_9IO_2 $. In its complete form, the six carbon atoms of benzene are interconnected with each other in a common form, and each substituent is interconnected with the benzene at the above position. In this case, the co-relationship between the carbon oxides and benzene of the ethyl ester group can give a certain degree of chemical activity and physical rationality of the compound. The iodine atom is also affected by the reaction activity and properties of the compound due to its atom semi-large and low-density properties. The methyl group changes the density of the sub-cloud on the benzene, which affects the integrity of the compound.
What are the main uses of Ethyl 2-iodo-5-methylbenzoate?
Ethyl + 2-iodo-5-methylbenzoate, which is 2-iodo-5-methylbenzoate, has a wide range of uses.
In the field of pharmaceutical chemistry, it can be a key intermediate for the synthesis of special drugs. Due to its unique chemical structure, different functional groups can be introduced through a series of reactions to construct compounds with specific physiological activities. For example, the development of new antibacterial drugs, by means of structural modification, may be able to produce drugs with strong inhibitory effect on specific bacteria.
In the field of materials science, it also has its uses. Using this as a raw material, through polymerization or other reactions, or materials with special optical and electrical properties can be prepared. For example, synthesizing new organic optoelectronic materials for use in devices such as organic Light Emitting Diodes (OLEDs) or solar cells may improve their performance.
In the fragrance industry, 2-iodine-5-methylbenzoate ethyl ester can be modified appropriately to synthesize fragrance components with unique aromas, adding a different flavor to fragrance formulations.
In the field of organic synthesis, it is an important synthetic building block. Chemists can use it to perform various classical organic reactions, such as nucleophilic substitution, coupling reactions, etc., to construct complex organic molecules and expand the variety and application of organic compounds.
What are the synthetic methods of Ethyl 2-iodo-5-methylbenzoate?
There are several common methods for preparing Ethyl 2-iodo-5-methylbenzoate (2-iodo-5-ethyl methylbenzoate).
One of them can be started from 2-methylbenzoic acid. First, 2-methylbenzoic acid and ethanol are esterified under the catalysis of concentrated sulfuric acid to form 2-ethyl methylbenzoate. This reaction needs to be carried out under heating conditions, and concentrated sulfuric acid acts as both a catalyst and a water absorption effect to promote the reaction to move in the direction of ester formation. Then, ethyl 2-methylbenzoate is iodized. Ethyl 2-iodo-5-methylbenzoate can be obtained by oxidizing iodine to a positive iodine ion with higher activity by hydrogen peroxide and introducing an iodine atom at the 2-position of the benzene ring.
Second, ethyl 5-methyl-2-nitrobenzoate can be obtained from 5-methyl-2-nitrobenzoate. First, ethyl 5-methyl-2-nitrobenzoate is reduced under acidic conditions with iron powder or zinc powder to transform the nitro group into an amino group to obtain ethyl 5-methyl-2-aminobenzoate. Then, 5-methyl-2-aminobenzoate ethyl ester is diazotized with sodium nitrite in hydrochloric acid solution to form a diazonium salt. After that, in the presence of potassium iodide, the diazonium group is replaced by an iodine atom to obtain the target product Ethyl 2-iodo-5-methylbenzoate.
Third, 2-bromo-5-methylbenzoate ethyl ester is used as the raw material. Ethyl 2-iodo-5-methylbenzoate was obtained by palladium-catalyzed halogen exchange reaction, using potassium iodide as the iodine source, heating the reaction in the presence of appropriate ligands (such as tri-tert-butylphosphine, etc.) and bases (such as potassium carbonate), so that the bromine atom was replaced by the iodine atom to obtain Ethyl 2-iodo-5-methylbenzoate. This method requires attention to the control of reaction conditions to ensure the activity of the palladium catalyst and the smooth progress of the reaction.
What are the physical properties of Ethyl 2-iodo-5-methylbenzoate?
Ethyl 2-iodo-5-methylbenzoate (ethyl 2-iodo-5-methylbenzoate) is also an organic compound. Its physical properties are quite impressive.
Looking at its properties, it is mostly liquid at room temperature. Due to the characteristics of its molecular structure, the intermolecular force is not strong enough to condense into a solid state. Its color is colorless and transparent, or slightly yellowish, such as the morning light pouring on the clear liquid, with a slightly yellowish rhyme in the clarity.
When it comes to the boiling point, due to the structure of benzene ring, ester group and iodine atom in the molecule, the interaction is complex, and the boiling point is in a certain range, about a relatively high temperature. Because more energy is required to overcome the intermolecular forces, the liquid state is converted to a gaseous state.
As for the melting point, it is relatively low, because the molecular arrangement is not highly regular, the lattice energy is limited, and the transformation between solid and liquid state is easier.
Its density also has characteristics, which is heavier than water, so if it is mixed with water, it often sinks underwater, like a pearl falling into a deep pool. In terms of solubility, the compound is quite miscible in organic solvents such as ethanol and ether. Due to the principle of "similar miscibility", the polarity of its molecules is similar to that of organic solvents and can be miscible with each other. However, in water, its solubility is poor. Because the overall polarity of the molecule is limited, it is difficult to fuse with water molecules with extremely strong polarity, just like the difficulty of mixing oil and water.
Its refractive index is also one of the unique physical properties. When light passes through this compound, it is refracted to a specific degree, as if light is meandering in a unique path, reflecting the influence of its internal structure on light propagation.
In summary, the physical properties of Ethyl 2-iodo-5-methylbenzoate are determined by its molecular structure, and each property is interrelated, which is of great significance in the research and application of organic chemistry.
What are the safety precautions for Ethyl 2-iodo-5-methylbenzoate?
Ethyl 2-iodo-5-methylbenzoate is ethyl 2-iodo-5-methylbenzoate. This product is related to safety and requires caution. The following matters must be kept in mind.
First, this product is chemically active or potentially harmful. Touch the skin, or cause discomfort, or even burns; if it is not carefully entered into the eyes, it will cause serious damage and can cause eye diseases. When operating, protective equipment, such as gloves and goggles, must be worn to prevent direct contact.
Second, the smell is unpleasant and irritating. If inhaled, its volatile gas can cause respiratory discomfort, causing cough, asthma and other symptoms. Therefore, the operation should be carried out in a well-ventilated place or in a fume hood, so that the volatile gas can be quickly discharged and avoid inhalation.
Third, flammable. In case of open flame or hot topic, there is a risk of combustion and explosion. When storing and using, keep away from fire and heat sources, and do not approach flammable materials. Fireworks are strictly prohibited at the operation site to prevent accidents.
Fourth, the waste of this material should not be discarded at will. Because it may contain harmful substances, pollute the environment. It should be properly disposed of in accordance with relevant regulations and handed over to professional institutions for recycling and disposal.
Fifth, when storing, it should be placed in a cool, dry and ventilated place. Keep away from oxidants, strong acids, strong alkalis, etc., to prevent chemical reactions. It should also be sealed and stored to avoid deterioration caused by contact with air and moisture.
In short, the operation of Ethyl 2-iodo-5-methylbenzoate requires safety first, strict procedures are followed, and proper disposal is completed to ensure the safety of personnel and the environment is not polluted.