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Product Name | 3-(2,4-Dichlorophenyl)-2-(2-nitro-4-trifluoromethylphenyl)acrylic acid |
Cas Number | 146224-94-8 |
Formula | C16H8Cl2F3NO4 |
Molar Mass | 420.14 g/mol |
Property 1 | Melting Point: 185-187°C |
Property 2 | Boiling Point: Not available |
Property 3 | Solubility in Water: Insoluble |
Property 4 | Appearance: Solid |
Property 5 | Density: Not available |
Property 6 | pKa: Not available |
Property 7 | Flash Point: Not available |
Property 8 | Refractive Index: Not available |
Property 9 | Vapor Pressure: Not available |
Property 10 | Stability: Stable under recommended storage conditions |
What are the main applications of 3-(2,4-dichlorophenyl)-2-(2-nitro-4-trifluoromethylphenyl)acrylic acid?
3-(2,4-dichlorophenyl)-2-(2-nitro-4-trifluoromethylphenyl)acrylic acid has several main applications.
One significant application is in the field of pesticides.Pesticides is one of the most important applications. This compound can be used to develop new types of pesticides.This compound can be used in the development of new pesticides. Its unique chemical structure may endow it with properties that can effectively target and control certain pests.Its unique chemical composition may give it properties that allow it to target and control pests. For example, it might act as an insecticide, interfering with the physiological processes of insects.It could, for example, act as an insecticide by interfering with the physiological functions of insects. Insects have specific biochemical pathways, and the chemical structure of this acrylic acid could interact with key enzymes or receptors in these pathways.The chemical structure of acrylic acid may interact with key receptors or enzymes in biochemical pathways. By blocking or disrupting these essential functions, it can prevent insects from feeding, growing, or reproducing, thus reducing pest populations and protecting crops.By blocking or disrupting the essential functions of insects, it can reduce pest populations and protect crops.
In the area of herbicides, 3-(2,4-dichlorophenyl)-2-(2-nitro-4-trifluoromethylphenyl)acrylic acid also shows potential. It can be designed to inhibit the growth of unwanted plants.It can be designed in a way to prevent unwanted plants from growing. Herbicides work by targeting specific metabolic processes in plants, such as photosynthesis or amino acid synthesis.Herbicides target specific metabolic processes within plants, like photosynthesis or amino acids synthesis. The distinct structure of this acrylic acid might be able to specifically bind to proteins or enzymes involved in these plant - specific processes.This acrylic acid's unique structure may be able specifically to bind to enzymes or proteins involved in these specific plant processes. This would lead to the disruption of normal plant growth, causing the weeds to wither and die, which is crucial for maintaining the health and productivity of agricultural fields, orchards, and lawns.This would disrupt normal plant growth and cause weeds to wither, a crucial step in maintaining the health and productivity for agricultural fields, orchards and lawns.
Furthermore, in the realm of pharmaceutical research, this compound may have value.This compound could also be of value in the field of pharmaceutical research. Some substances with similar chemical scaffolds have been found to possess biological activities relevant to human health.Some substances with similar chemical structures have biological activities that are relevant to human health. It could potentially be investigated for its anti - inflammatory or anti - tumor properties.It could be tested for its anti-inflammatory or anti-tumor properties. Scientists might study how it interacts with human cells at the molecular level.Scientists could study its interaction with human cells on a molecular scale. For instance, it may be able to modulate certain signaling pathways in cells.It may modulate certain cell signaling pathways, for example. If it can interfere with the abnormal signaling that occurs in cancer cells or inflammatory responses, it could be a starting point for the development of new drugs.It could be used to develop new drugs if it can interfere with abnormal signaling in cancer cells or inflammation responses. Although more in - depth research is required to fully explore these possibilities, its chemical structure provides a basis for such investigations.It is important to do more research in order to fully explore the possibilities. However, its chemical structure can be used as a starting point for further investigations. Overall, 3-(2,4-dichlorophenyl)-2-(2-nitro-4-trifluoromethylphenyl)acrylic acid has diverse potential applications in agriculture and potentially in the pharmaceutical industry.
What are the safety precautions when handling 3-(2,4-dichlorophenyl)-2-(2-nitro-4-trifluoromethylphenyl)acrylic acid?
3-(2,4 - dichlorophenyl)-2-(2 - nitro - 4 - trifluoromethylphenyl)acrylic acid is a chemical compound. When handling it, the following safety precautions should be taken.Safety precautions are necessary when handling this chemical compound.
First, in terms of personal protective equipment.Personal protective equipment is the first thing to consider. Wear appropriate chemical - resistant gloves.Wear gloves that are resistant to chemicals. Nitrile gloves are often a good choice as they can provide a certain degree of protection against the potential contact of this chemical with the skin.Nitrile gloves can offer a degree of protection from the chemical. Skin contact may lead to irritation, and in severe cases, it could cause more serious damage.Contact with the skin can cause irritation and, in some cases, more serious damage. Also, put on safety goggles to protect the eyes.Wear safety goggles as well to protect your eyes. If the chemical splashes into the eyes, it can cause intense pain, damage to the cornea, and potentially vision - threatening problems.If the chemical splashes in the eyes, it may cause severe pain, corneal damage, and even vision-threatening problems. A lab coat or other protective clothing should be worn to prevent the chemical from getting on regular clothes and potentially coming into contact with the body.Wear a lab coat or another protective clothing to prevent the chemical from contacting the body.
Second, work in a well - ventilated area.Second, make sure you are working in an area that is well-ventilated. If possible, use a fume hood.If possible, work under a fume-hood. This chemical may release vapors, and inhaling these vapors can irritate the respiratory tract, causing coughing, shortness of breath, and in more serious situations, it could affect the lungs and other respiratory organs.Inhaling vapors from this chemical can cause irritation to the respiratory tract. This can lead to coughing and shortness of breathe. In more serious cases, it may affect the lungs or other respiratory organs. A fume hood can effectively draw away the vapors, reducing the risk of inhalation.A fume hood will effectively draw the vapors away, reducing the risk.
Third, when handling the substance, be extremely careful to avoid spills.Third, avoid spills by being extremely careful when handling the substance. In case of a spill, immediately take appropriate clean - up measures.If a spill occurs, take immediate action to clean it up. First, evacuate the area to prevent others from being exposed.First, evacuate the affected area to protect others. Then, use absorbent materials such as sand or special chemical - absorbing pads to contain the spill.Use absorbent materials like sand or chemical-absorbing pads to contain spills. Do not use water to clean it immediately without knowing its solubility and potential reactivity with water, as this may spread the chemical.You should not use water without first knowing the chemical's solubility or potential reactivity to water. This could spread the chemical. The absorbed chemical should be disposed of in accordance with local environmental protection and waste disposal regulations.The absorbed chemical must be disposed according to local environmental protection and waste disposal laws.
Fourth, do not eat, drink, or smoke while handling this chemical.Fourth, don't eat, smoke, or drink while handling this chemical. It could accidentally contaminate food or drinks, leading to ingestion, which can have serious consequences for the digestive system and overall health.It can contaminate food and drinks, causing ingestion. This can have serious effects on the digestive system. After handling, thoroughly wash hands and any other exposed skin areas with soap and water to ensure no residue remains.After handling, wash your hands and any exposed skin with soap and warm water to remove any residue.
Finally, be familiar with the first - aid procedures in case of exposure.Be familiar with the first-aid procedures in case you are exposed. In case of skin contact, immediately remove contaminated clothing and wash the affected area with plenty of water for at least 15 minutes.If skin contact occurs, remove all contaminated clothing immediately and wash the affected area for at least 15 min. Seek medical attention if irritation persists. For eye contact, rinse the eyes with copious amounts of water for at least 15 minutes, lifting the eyelids occasionally, and then seek immediate medical help.If you have eye contact, rinse your eyes with plenty of water for 15 minutes while lifting the eyelids periodically. Then seek immediate medical attention. If inhaled, move to fresh air immediately.If inhaled, immediately move to fresh air. If breathing is difficult, provide oxygen and call for medical assistance.If breathing is difficult, call for medical help and provide oxygen.
What is the chemical structure of 3-(2,4-dichlorophenyl)-2-(2-nitro-4-trifluoromethylphenyl)acrylic acid?
1. Component parts understandingUnderstanding component parts - 3 - (2,4 - dichlorophenyl): This part indicates that at the 3 - position of the acrylic acid backbone, there is a phenyl ring substitution.This part indicates a phenyl substitution at the 3 – position of the backbone of acrylic acid. The phenyl ring has two chlorine atoms, one at the 2 - position and another at the 4 - position relative to the point of attachment to the acrylic acid structure.The phenyl has two chlorine atoms. One is at the 2 – position and the other at the 4 – position relative to the point where the acrylic acid structure attaches. A phenyl ring is a six - membered aromatic hydrocarbon ring with the formula \(C_6H_5\).A phenyl is a six-membered aromatic hydrocarbon with the formula (C_6H_5). When two chlorine atoms are substituted, the structure of the 2,4 - dichlorophenyl group can be visualized as a benzene ring where two hydrogen atoms have been replaced by chlorine atoms at the 2 and 4 positions.The structure of the 2,4-dichlorophenyl can be visualized by substituting two chlorine atoms. Two hydrogen atoms in the 2 and 4 positions have been replaced with chlorine atoms.
- 2 - (2 - nitro - 4 - trifluoromethylphenyl): At the 2 - position of the acrylic acid, there is another phenyl ring substitution. This phenyl ring has a nitro group (\(-NO_2\)) at the 2 - position and a trifluoromethyl group (\(-CF_3\)) at the 4 - position relative to the point of attachment to the acrylic acid.This phenyl group has a nitro group (\(-NO_2()) in the 2 – position and a Trifluoromethyl Group (\(-CF_3()) in the 4 – position relative to point of attachment. The nitro group consists of one nitrogen atom double - bonded to two oxygen atoms (\(O = N - O\)), and the trifluoromethyl group has a carbon atom bonded to three fluorine atoms (\(CF_3\)).The nitro group is made up of one nitrogen double-bonded with two oxygen atoms. ((O =N - O \)),, and the trifluoromethyl ring has a carbon atom attached to three fluorine molecules.
- Acrylic acid backbone: Acrylic acid has the basic structure \(CH_2=CH - COOH\).Acrylic acid is a simple carboxylic acid with a double carbon-carbon bond ((C = C)) and a carboxyl group ((-COOH). It is a simple unsaturated carboxylic acid, with a carbon - carbon double bond (\(C = C\)) and a carboxyl group (\(-COOH\)).It is an unsaturated carboxylic simple acid with a double carbon-carbon bond ((C=C)) and carboxyl group (\(-COOH \)). The double bond gives it the ability to participate in addition reactions, and the carboxyl group is responsible for its acidic properties.The double bond allows it to participate in addition reaction, and the carboxyl groups is responsible for the acidic properties.
2. Overall structure assemblyOverall Structure Assembly
- Connecting these groups to the acrylic acid backbone, the 3 - (2,4 - dichlorophenyl) group is attached to the carbon atom in the acrylic acid that is adjacent to the carbonyl carbon of the carboxyl group (the beta - carbon in the acrylic acid structure).The 3 - (2 - dichlorophenyl - 4,4 - trifluoromethylphenyl) group, which connects these groups to acrylic acid's backbone, is attached to the adjacent carbon atom of the carboxyl (the beta-carbon in the structure of acrylic acid). The 2 - (2 - nitro - 4 - trifluoromethylphenyl) group is attached to the other carbon of the carbon - carbon double bond in the acrylic acid.
- In terms of the chemical formula, considering the atomic composition of each part:- In terms the chemical formula, taking into account the atomic compositions of each part
- The 2,4 - dichlorophenyl group contributes \(C_6H_3Cl_2\).The 2,4-dichlorophenyl group contributes to (C_6H_3Cl_2). The 2 - nitro - 4 - trifluoromethylphenyl group contributes \(C_7H_3F_3NO_2\). The acrylic acid backbone contributes \(C_3H_4O_2\).The acrylic acid backbone contributes to (C_3H_4O_2).
- Combining these, the overall chemical formula of 3 - (2,4 - dichlorophenyl) - 2 - (2 - nitro - 4 - trifluoromethylphenyl)acrylic acid can be calculated. The carbon atoms from each part sum up: \(6 + 7+3=16\) carbon atoms.The sum of the carbon atoms in each part is: (6+7+3=16). The hydrogen atoms: \(3 + 3+4 = 10\) hydrogen atoms.The hydrogen atoms are: (3+3+4=10) hydrogen. Chlorine atoms: 2.Chlorine atoms are 2. Fluorine atoms: 3.Fluorine atoms : 3. Nitrogen atom: 1. Oxygen atoms: \(2 + 2=4\). So the chemical formula is \(C_16H_10Cl_2F_3NO_4\).
- The structure has a planar - like geometry around the carbon - carbon double bond of the acrylic acid part due to the sp2 hybridization of the carbon atoms in the double bond.Due to the sp2 hybridization of carbon atoms within the double bond, the structure has a planar-like geometry around the double carbon bond of the acrylic part. The phenyl rings also have a planar structure due to their aromatic nature.Due to their aromatic nature, the phenyl rings have a similar planar structure. The nitro group and trifluoromethyl group on one phenyl ring and the chlorine atoms on the other phenyl ring protrude out from the planes of their respective phenyl rings, adding to the overall three - dimensional complexity of the molecule.The nitro and trifluoromethyl groups on one phenyl and the chlorine atoms in the other phenyl are protruding from the planes of the respective phenyl rings. This adds to the overall complexity of the three-dimensional molecule. The carboxyl group at the end of the acrylic acid backbone can participate in hydrogen bonding and acid - base reactions, which can influence the physical and chemical properties of the compound.The carboxyl group on the backbone of acrylic acid can participate in acid-base reactions and hydrogen bonding, which can affect the physical and chemical properties.
What are the physical and chemical properties of 3-(2,4-dichlorophenyl)-2-(2-nitro-4-trifluoromethylphenyl)acrylic acid?
3-(2,4 - dichlorophenyl)-2-(2 - nitro - 4 - trifluoromethylphenyl)acrylic acid is an organic compound with specific physical and chemical properties.
Physical Properties
Appearance: It is likely to be a solid at room temperature.Appearance: This acid is likely to be solid at room temperatures. Many organic acids with relatively complex aromatic structures like this one tend to exist in solid form due to the strong intermolecular forces such as van der Waals forces and hydrogen bonding.Due to strong intermolecular interactions such as van der Waals and hydrogen bonds, many organic acids with relatively complicated aromatic structures like this tend to exist as solids. The exact color might range from white to off - white or pale yellow, common colors for organic solids containing aromatic rings and halogen, nitro, and carboxylic acid functional groups.The color can range from off-white to pale yellow. These are common colors for organic compounds containing aromatic rings, halogens, nitro and carboxylic acids functional groups.
Melting Point: The melting point is determined by the strength of the intermolecular forces.Melting Point: The strength of intermolecular forces determines the melting point. The presence of multiple halogen atoms (chlorine and fluorine), a nitro group, and the carboxylic acid group all contribute to relatively strong intermolecular interactions.The presence of multiple chlorine and fluorine atoms, a nitro group and the carboxylic acids group all contribute to relatively high intermolecular forces. The melting point is expected to be relatively high, perhaps in the range of 150 - 250 degC.The melting point should be high, possibly between 150 and 250 degC. The bulky and polar nature of the functional groups restricts the movement of the molecules, requiring a significant amount of energy to break the intermolecular forces and transition from the solid to the liquid state.The bulky and polar natures of the functional groups restricts movement of the molecules. It takes a considerable amount of energy to break intermolecular force and transition from a solid to a liquid state.
Solubility: In terms of solubility, it is sparingly soluble in water.It is only sparingly soluble. The large hydrophobic aromatic rings, along with the relatively non - polar halogen and nitro groups, dominate the molecule's overall hydrophobicity.The hydrophobicity of the molecule is dominated by the large hydrophobic aromatic ring, as well as the non-polar halogens and nitro groups. However, it may show some solubility in polar organic solvents such as ethanol, methanol, and dimethyl sulfoxide (DMSO).It may be soluble in polar organic solvents like ethanol, methanol and dimethyl sulfoxide. The carboxylic acid group can form hydrogen bonds with these polar solvents, facilitating some degree of dissolution.The carboxylic group can form hydrogen bond with these polar organic solvents, which may facilitate some degree of dissolution.
Chemical Properties
Acidity: The carboxylic acid group (-COOH) imparts acidic properties to the compound.Acidity: The carboxylic group (-COOH), gives the compound acidic properties. It can donate a proton in an aqueous solution or in the presence of a base.It can donate a proton in an aqueous or base-containing solution. The pKa value, which measures the acidity, is influenced by the electron - withdrawing groups in the molecule.The electron-withdrawing groups within the molecule influence the pKa value which measures acidity. The nitro group (-NO2) and the trifluoromethyl group (-CF3) are strong electron - withdrawing groups.The trifluoromethyl (-CF3) and nitro groups (-NO2) are both strong electron-withdrawing groups. Their presence stabilizes the conjugate base formed after the loss of a proton from the carboxylic acid group, making the acid more acidic compared to a simple aliphatic carboxylic acid.They stabilize the conjugate base that is formed after the carboxylic group loses a proton, making the acid acidic in comparison to a simple carboxylic aliphatic acid.
Reactivity of Functional Groups: The double bond in the acrylic acid part of the molecule is reactive.Reactivity of functional groups: The double bond of the acrylic acid molecule is reactive. It can undergo addition reactions, such as electrophilic addition with reagents like bromine or hydrogen halides.It can undergo electrophilic additions with reagents such as bromine or hydrogen chlorides. The halogen atoms on the phenyl rings can potentially participate in substitution reactions under appropriate conditions, for example, nucleophilic aromatic substitution reactions if the reaction conditions are carefully controlled.Under the right conditions, the halogens on the phenyl ring can participate in substitution reactions. For example, nucleophilic substitution reactions, if the conditions are carefully controlled. The nitro group can be reduced to an amino group through various reducing agents, which can then be used to further modify the molecule for the synthesis of more complex compounds.The nitro group is reduced to an ammonium group by various reducing agents. This amino group can then be used for further modification of the molecule to synthesize more complex compounds. The carboxylic acid group can also participate in reactions like esterification, where it reacts with alcohols in the presence of an acid catalyst to form esters.The carboxylic group can also be used in reactions such as esterification where it reacts alcohols with an acid catalyst in order to form esters.
How to store 3-(2,4-dichlorophenyl)-2-(2-nitro-4-trifluoromethylphenyl)acrylic acid safely?
3-(2,4 - dichlorophenyl)-2-(2 - nitro - 4 - trifluoromethylphenyl)acrylic acid is a chemical compound that requires proper storage to ensure safety. Here are some guidelines for its safe storage.Here are some guidelines to ensure its safe storage.
First, store it in a cool and dry place.Store it in a dry, cool place. High temperatures can accelerate chemical reactions, potentially leading to decomposition or changes in the chemical properties of the compound.High temperatures can speed up chemical reactions and cause decomposition or changes to the chemical properties of a compound. A temperature - controlled environment, such as a cool storage room with a temperature range between 15 - 25 degrees Celsius, is ideal.Ideal is a temperature-controlled environment, such a cool storage area with a temperature range of 15 to 25 degrees Celsius. Excessive moisture can also cause issues.A high level of moisture can also be problematic. Moisture can initiate hydrolysis reactions, especially if the compound has reactive functional groups.Moisture may initiate hydrolysis reactions in compounds with reactive functional groups. So, ensure the storage area has low humidity, and if possible, use desiccants in the storage containers.Use desiccants to reduce the humidity in the storage area and, if possible, place them inside the containers.
Second, keep it away from direct sunlight.Second, keep the item away from direct sunlight. Ultraviolet light from the sun can cause photochemical reactions.Photochemical reactions can be caused by ultraviolet light from the sun. These reactions may break chemical bonds in the 3-(2,4 - dichlorophenyl)-2-(2 - nitro - 4 - trifluoromethylphenyl)acrylic acid molecule, changing its structure and properties. Storing it in opaque containers or in a dark room can prevent this.This can be prevented by storing it in opaque containers and in a dark environment.
Third, store it in a well - ventilated area.Third, store the product in an area that is well-ventilated. Some chemical compounds may release small amounts of volatile substances over time.Over time, some chemical compounds can release small amounts volatile substances. If the storage area is not well - ventilated, these vapors can build up, creating a potential fire or explosion hazard, especially if the compound is flammable or reactive.These vapors can accumulate if the storage area is poorly ventilated. This could create a fire or explosion risk, especially if the chemical compound is flammable. Good ventilation helps to disperse any such vapors safely.A good ventilation system is essential to safely disperse such vapors.
Fourth, separate it from incompatible substances.Separate it from substances that are incompatible. This compound may react violently with strong oxidizing agents, reducing agents, bases, or acids.This compound can react violently with acids, bases, reducing agents or strong oxidizing agents. For example, acids and bases can cause chemical reactions that break down the acrylic acid structure.Acids and bases, for example, can cause chemical reactions which break down the structure of acrylic acid. Oxidizing agents can potentially oxidize the various functional groups in the molecule, leading to unwanted products.Oxidizing agents may oxidize functional groups within the molecule and produce unwanted products. Use separate storage cabinets or areas for different classes of chemicals to avoid accidental contact.Separate storage cabinets or areas should be used for different classes to avoid accidental contact.
Finally, label the storage container clearly.Label the container clearly. The label should include the name of the compound, its chemical formula, any relevant hazard warnings such as toxicity, flammability, or reactivity information.Label the container clearly with the name of the compound and its chemical formula. Also include any relevant hazards warnings, such as toxicity or flammability. This clear labeling helps anyone handling the storage area to be aware of the potential risks associated with the 3-(2,4 - dichlorophenyl)-2-(2 - nitro - 4 - trifluoromethylphenyl)acrylic acid. Also, maintain an inventory of the stored compound, noting the quantity, date of storage, and any changes in its appearance or properties over time.Maintain an inventory of the compound stored, noting its quantity, the date of storage, as well as any changes to its appearance or properties. This way, proper safety and management of the stored chemical can be ensured.So, the safety and management of a stored chemical can be assured.