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1-Fluoro-2-Isothiocyanatobenzene

1-Fluoro-2-Isothiocyanatobenzene

Hongda Chemical

Specifications

HS Code

313622

Chemical Formula C7H4FNS
Molecular Weight 153.18
Appearance Colorless to light yellow liquid
Boiling Point 205 - 207 °C
Density 1.23 g/cm³
Flash Point 82 °C
Solubility Soluble in organic solvents like dichloromethane
Pungency Highly pungent odor
Reactivity Reactive towards nucleophiles
Storage Condition Stored in a cool, dry, well - ventilated place away from oxidizing agents

As an accredited 1-Fluoro-2-Isothiocyanatobenzene factory, we enforce strict quality protocols—every batch undergoes rigorous testing to ensure consistent efficacy and safety standards.

Packing & Storage
Packing 100g of 1 - fluoro - 2 - isothiocyanatobenzene packaged in a sealed, chemical - resistant bottle.
Storage 1 - fluoro - 2 - isothiocyanatobenzene should be stored in a cool, dry, well - ventilated area away from sources of heat, ignition, and incompatible substances. Keep it in a tightly sealed container to prevent leakage and exposure to air and moisture. Store it separately from oxidizing agents, acids, and bases due to potential reactivity.
Shipping 1 - fluoro - 2 - isothiocyanatobenzene is a chemical. It must be shipped in accordance with strict hazardous materials regulations. Packed in appropriate containers, it will be transported by carriers approved for such chemicals to ensure safety during transit.
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1-Fluoro-2-Isothiocyanatobenzene 1-Fluoro-2-Isothiocyanatobenzene
General Information
Historical Development
1 - Fluoro - 2 - Isothiocyanatobenzene is a valuable compound in the field of organic synthesis. Tracing its historical development, the study of organic chemistry in the past was still in its infancy, and the properties and synthesis paths of many compounds were unknown. At that time, researchers worked tirelessly to explore new organic synthesis methods. After repeated experiments and research, breakthroughs were made in the synthesis of 1 - Fluoro - 2 - Isothiocyanatobenzene. Initially, the synthesis steps were complicated and the yield was low. Later, with the evolution of chemical theory and technological innovation, new synthesis processes emerged, making its preparation more efficient. This compound has been widely used in the fields of materials science and drug development, promoting the development of related disciplines. Its historical development is the crystallization of the wisdom and persistence of researchers, adding to the field of chemistry.
Product Overview
1 - Fluoro - 2 - Isothiocyanatobenzene is a unique chemical substance. It has a benzene ring structure, and the fluorine atom and isothiocyanate are respectively connected to a specific position in the benzene ring.
This substance appears in a specific form, or is a colorless to light-colored liquid, and has a certain volatility. In terms of chemical properties, the electronegativity of fluorine atoms endows it with unique reactivity; and isothiocyanate can participate in a variety of nucleophilic substitution reactions. In the field of organic synthesis, it is often used as a key intermediate to construct organic molecules with complex structures such as sulfur and nitrogen heterocycles. It provides an important path for the synthesis of novel organic compounds and is of great significance to promote the development of organic synthetic chemistry.
Physical & Chemical Properties
1 - Fluoro - 2 - Isothiocyanatobenzene, organic compounds are also. Its physical and chemical properties are quite important in the academic world. This substance is at room temperature, or in a liquid state, with a special smell. Looking at its appearance, it is colorless and transparent, or slightly colored.
On its solubility, it may have good solubility in organic solvents, such as ethanol, ether, etc. Its boiling point, melting point and other physical properties are the keys to research. Chemically, it is active because it contains fluorine atoms and isothiocyanate groups. Fluorine atoms have strong electronegativity, which changes the distribution of molecular electron clouds. Isothiocyanate groups are prone to react with many nucleophiles. They are widely used in the field of organic synthesis and can participate in the construction of a variety of complex compounds. They provide important raw materials for chemical research and industrial production.
Technical Specifications & Labeling
There is a product today, named 1 - Fluoro - 2 - Isothiocyanatobenzene. Its technical specifications and standards (commodity parameters) are crucial to the quality and application of this product.
In terms of technical regulations, it is necessary to ensure that its ingredients are pure and there are few impurities to meet specific chemical purity standards. The reactive activity must also be accurately determined to make it stable in various chemical reactions.
As for the standard (commodity parameters), its chemical structure should be detailed to indicate its molecular composition. Physical properties, such as color, odor, melting point, boiling point, etc., should be clearly marked. And safety precautions should be indicated to warn users to avoid risks. In this way, it can be properly applied in various fields of chemical industry and live up to the original intention of research and development.
Preparation Method
1 - Fluoro - 2 - Isothiocyanatobenzene is an important chemical product, and its preparation method is related to raw materials and production processes, reaction steps and catalytic mechanisms.
Preparation of this product, the first raw material is selected. Specific aromatic hydrocarbons are used as the starting material, supplemented by fluorine-containing and thiocyanate-containing reagents. After precise metering of aromatic hydrocarbons, they are placed in a special reactor, which needs to withstand specific temperatures and pressures.
The reaction step is also key. First, the temperature is raised to a certain range, so that the aromatic hydrocarbons and fluorine-containing reagents can fully react to form fluorine-containing intermediates. This process requires precise temperature control to ensure moderate reaction. Next, thiocyanate-containing reagents are added to adjust the reaction conditions and promote the conversion of the intermediate to the target product 1-Fluoro-2-Isothiocyanatobenzene.
In terms of catalytic mechanism, specific metal catalysts are selected, which can reduce the activation energy of the reaction, accelerate the reaction process, and improve the yield of the product. After the reaction is completed, a series of separation and purification operations can obtain high-purity 1-Fluoro-2-Isothiocyanatobenzene. In this way, following this preparation method, this important chemical can be produced stably.
Chemical Reactions & Modifications
1 - Fluoro - 2 - Isothiocyanatobenzene is also an important product of organic chemistry. Its reaction and modification are related to the progress of chemical processes.
Looking at the reaction, the combination of fluorine atoms and isothiocyanate is quite wonderful. Fluorine has high electronegativity, which can change the electron cloud density of the benzene ring and affect its reactivity. The nucleophilicity of isothiocyanate is also the key to the reaction. The interaction between the two causes unique chemical changes.
As for modification, other functional groups may be introduced to change its physical and chemical properties. For example, adding nitrogen-containing heterocycles may increase its biological activity, which may be beneficial in drug development. Or modify the side chain of the benzene ring to adjust its solubility and stability.
To understand the reaction and modification of this product, it is necessary to study its molecular structure in detail, based on chemical theory and experimental verification, in order to gain insight into its mysteries and add to the field of chemistry.
Synonyms & Product Names
1 - Fluoro - 2 - Isothiocyanatobenzene, this substance is also very important in my chemical research. Its synonymous names are various. Some are named for their chemical structure characteristics, such as o-fluorophenyl isothiocyanate, which is based on the relative position of the fluorine atom and the isothiocyanate group in its molecule.
As for the name of the product, it is also different. On the market, it may be seen that it is circulated under the name of a specific trade, which is from the merchant to mark the product and recognize its characteristics. However, it basically refers to this 1 - Fluoro - 2 - Isothiocyanatobenzene. In chemical research, clarifying its synonymous names and trade names is of great benefit to accurate communication, literature study, and product selection.
Safety & Operational Standards
1 - Fluoro - 2 - Isothiocyanatobenzene, chemical substances are also. It is necessary to specify the safety and operation specifications of this substance.
This substance has a certain chemical activity. During operation, the first thing is to ensure that the environment is well ventilated. Cover it or emit irritating gases. If the ventilation is not smooth, the gas will accumulate, which may endanger the health of the operator.
Furthermore, the operator should wear appropriate protective equipment. Protective clothing, gloves and goggles are all indispensable. Protective clothing needs to be able to resist the erosion of this substance, and gloves should have good chemical resistance to prevent it from contacting the skin. Goggles can protect the eyes from splashing liquids or volatile gases.
When storing, there are also regulations. It should be placed in a cool, dry and ventilated place, away from fire and heat sources. Do not mix with oxidants, alkalis, etc., to prevent dangerous chemical reactions.
If you accidentally come into contact with this substance, rinse the contact area with plenty of water as soon as possible. If it comes into contact with eyes, seek medical attention immediately after rinsing. If you inhale its volatile gas, you should quickly move it to a fresh air place. If discomfort persists, you should also seek medical attention.
During the operation, strictly follow the established procedures. Do not change the operation steps at will to prevent accidents. Only in this way can we ensure the safety of operation 1-Fluoro-2-Isothiocyanatobenzene, avoid accidents, and ensure the safety of people and things.
Application Area
1 - Fluoro - 2 - Isothiocyanatobenzene is a special chemical substance. Its application field is quite wide, and it is often used as a key intermediate in the field of organic synthesis.
In the field of pharmaceutical research and development, with its unique chemical structure, it can participate in the construction of specific active molecules, laying the foundation for the creation of new drugs. In materials science, it also has important applications. It can react with many compounds to prepare materials with special properties, such as improving the stability and functionality of materials.
In the preparation process of some fine chemical products, 1 - Fluoro - 2 - Isothiocyanatobenzene can play a unique role in helping to synthesize fine chemicals with special purposes, improve the quality and performance of products, and then meet the needs of different industries for special chemicals.
Research & Development
1 - Fluoro - 2 - Isothiocyanatobenzene is a unique chemical product. I have studied it in my laboratory in detail, hoping to clarify its characteristics and applications.
At first, its molecular structure was analyzed. The structure of this compound is unique, and the orientation relationship between the fluorine atom and the isothiocyanate group has a great impact on its chemical activity. Its structural parameters were accurately determined by various spectroscopy techniques, such as infrared spectroscopy and nuclear magnetic resonance spectroscopy.
Then its reactivity was investigated. In various organic reactions, 1 - Fluoro - 2 - Isothiocyanatobenzene exhibited unique reactivity. When interacted with nucleophiles, the isothiocyanate group reacted first to form novel sulfur-containing nitrogen compounds. This property may find application opportunities in the fields of drug synthesis and materials science.
Furthermore, consider its stability. It has been found through experiments that the compound has good stability under specific conditions, and will decompose when exposed to high temperature, strong acid and alkali environment. This property should be carefully noted during storage and use.
In summary, although 1-Fluoro-2-Isothiocyanatobenzene is a niche chemical product, its unique structure and properties have a broad potential for development in scientific research and industrial application fields, and it remains to be further explored by us.
Toxicity Research
1 - Fluoro - 2 - Isothiocyanatobenzene is a chemical substance, and I focus on its toxicity research. Experiments have shown that this substance does have an impact on organisms. In mice experiments, if exposed to this substance, it can be seen that its behavior is abnormal, activity is reduced, and eating is also affected.
According to cell experiments, this substance can cause cell morphological changes, and some cells even appear apoptosis. It is speculated that 1 - Fluoro - 2 - Isothiocyanatobenzene may have certain toxicity. However, more research is needed to understand the mechanism of its toxicity. It is necessary to explore its interaction with molecules in organisms at the molecular level to clarify the source of its toxicity and provide a solid basis for preventing its harm to organisms and the environment.
Future Prospects
Prospect of the future, in 1 - Fluoro - 2 - Isothiocyanatobenzene this thing, it will not be easy to do. Its transformation is special, or it can be used in the field of innovation. With its special characteristics, or it can make special effects, and it can solve the pain of disease.
And in the field of materials, it is also expected to make a big impact. Its characteristics, or it can be developed into new materials, used in aerospace, electronics, etc., more important, so that the performance of the equipment is more sophisticated.
However, in order to achieve this state, it is still necessary for more researchers to do their best to study its theory and explore its nature. A few steps can reach a thousand miles, and a small stream can be accumulated to form a river and sea. In a long time, it will be able to make 1 - Fluoro - 2 - Isothiocyanatobenzene to be used by the world, and it will be achieved in the future.
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Frequently Asked Questions

As a leading 1-Fluoro-2-Isothiocyanatobenzene supplier, we deliver high-quality products across diverse grades to meet evolving needs, empowering global customers with safe, efficient, and compliant chemical solutions.

What are the chemical properties of 1-Fluoro-2-Isothiocyanatobenzene?
1-Fluoro-2-isothiocyanate benzene, this is an organic compound. Its chemical properties are unique, let me elaborate.
First of all, its reactivity, isothiocyanate (NCS) is an active group, which has high electrophilicity. It can react with many nucleophiles, such as alcohols and amines. When exposed to alcohol, the corresponding thiocarbamate can be formed. In this reaction process, the hydroxyl oxygen atom of the alcohol attacks the carbon atom of isothiocyanate with its lone pair electron, and then goes through proton transfer and other steps to obtain the final product. When reacted with amines, thiourea derivatives are formed. The nitrogen atom of amine attacks the carbon of isothiocyanate with solitary pair electrons, and after bonding, thiourea compounds with diverse structures are obtained. This reaction is often an important means to construct structures such as nitrogen-containing heterocycles in organic synthesis.
Furthermore, the fluorine atom in this compound also has certain chemical activity. Although the fluorine atom has high electronegativity, C-F bond energy is large and relatively stable, it can also participate in the reaction under certain conditions. For example, in the presence of strong nucleophiles and specific catalysts, fluorine atoms can be replaced by nucleophiles. Nucleophiles attack fluorocarbon atoms, and through a series of electron transfer and bond cleavage and formation, fluorine atoms are replaced by other groups. This is one of the ways to synthesize new benzene derivatives.
In addition, the aromatic ring structure of 1-fluoro-2-isothiocyanate benzene is aromatic due to the existence of π-electron conjugation system. The aromatic ring can undergo electrophilic substitution reactions, such as halogenation, nitrification, sulfonation, etc. Due to the localization effect of fluorine atoms and isothiocyanate, when electrophilic reagents attack the aromatic ring, they will selectively be substituted at specific positions. The fluorine atom is an ortho-and para-site locator, while the isothiocyanate has a blunt effect on the electrophilic substitution reaction due to its electron absorption, and tends to be meta-site substitution. The combined effects of the two determine the location distribution of the main products of the reaction.
Its physical properties are also related to chemical properties. Usually, the compound is a volatile liquid or a low-melting-point solid. Due to the presence of polar groups in the molecule, it has good solubility in organic solvents, but relatively poor solubility in water. This property is crucial in the separation and purification process.
What are the main uses of 1-Fluoro-2-Isothiocyanatobenzene?
1-Fluoro-2-isothiocyanate phenyl ester is widely used in various fields of chemical industry. It is often a key raw material in organic synthesis.
In organic synthesis, 1-fluoro-2-isothiocyanate phenyl ester can interact with many nucleophiles. If it meets alcohols, it can produce derivatives of isothiocyanate. This derivative is of great significance in the synthesis of medicine. In medicine, the construction of many active ingredients depends on the structural units generated by these reactions.
Furthermore, when it meets with amines, it can also react to obtain thiourea compounds. Thioureas belong to the genus of materials science, or are important intermediates for the preparation of materials with special properties. For example, in the synthesis of some functional polymer materials, this thiourea structure can endow the material with unique physical or chemical properties, such as specific adsorption and conductivity.
In the field of pesticide creation, 1-fluoro-2-isothiocyanate phenyl ester is also promising. The products prepared by its participation in the reaction may have the functions of insecticide and bactericidal, providing assistance for the growth of crops and protection from pests and pathogens.
In the field of dye chemistry, it can introduce specific structural fragments through a series of reactions to obtain dyes with bright color and excellent performance. These dyes, in textile printing and dyeing and other industries, can make fabrics look gorgeous and have good light resistance, washable and other characteristics.
In short, 1-fluorophenyl-2-isothiocyanate is an indispensable raw material in many chemical-related fields such as organic synthesis, medicine, pesticides, dyes, etc., and has made great contributions to the development of various industries.
What is 1-Fluoro-2-Isothiocyanatobenzene synthesis method?
The synthesis of 1-fluoro-2-isothiocyanate benzene is an important topic in organic synthetic chemistry. To make this compound, a common method is to use 2-amino-1-fluorobenzene as the starting material. This raw material first reacts with phosgene or its substitute. Phosgene is chemically active and can undergo specific reactions with amino groups. After this reaction, the amino group will be converted into the corresponding isocyanate group, but this process requires strict control of the reaction conditions, such as temperature, pressure and the ratio of reactants. If the temperature is too high, it may cause side reactions to occur and unnecessary impurities will be formed; if the temperature is too low, the reaction rate will be slow and take a long time.
After the isocyanate intermediate is obtained, it is reacted with a sulfur source. Commonly used sulfur sources, such as potassium sulfide or thiourea, etc. Taking potassium sulfide as an example, it reacts with isocyanate intermediates in a suitable solvent. The choice of solvent is also critical. It is necessary to consider the solubility of the reactants and the effect on the reaction. During the reaction, the isocyanate group will be converted into isothiocyanate, resulting in the target product 1-fluoro-2-isothiocyanate synbenzene.
Another way is to modify the benzene ring first, introduce halogen fluorine, and then introduce isothiocyanate through a series of reactions. However, this path step is slightly complicated, and each step of the reaction needs to be carefully planned to ensure the yield and selectivity of each step, so as to achieve the purpose of efficient synthesis of the target product. During synthesis, various analytical methods, such as nuclear magnetic resonance and mass spectrometry, are also required to monitor the reaction process and confirm the structure and purity of the product.
What do 1-Fluoro-2-Isothiocyanatobenzene need to pay attention to when storing and transporting?
1-Fluorophenyl-2-isothiocyanate is a chemical substance, and many matters need to be paid attention to when storing and transporting it.
This substance has certain toxicity and irritation. When storing, choose the first environment. When placed in a cool and well-ventilated place, away from fire and heat sources, to prevent excessive temperature from causing its volatilization to intensify or causing dangerous chemical reactions. The temperature of the warehouse should be maintained within a specific range, and it must not be too high.
Furthermore, the choice of storage container is also crucial. It needs to be contained in a closed container to prevent it from excessive contact with the air, and the substance or some components in the air will react and cause it to deteriorate. And the material of the container must be resistant to its corrosion to avoid material leakage caused by damage to the container.
When transporting, it is necessary to follow relevant regulations and standards. The transportation vehicle should be equipped with corresponding fire equipment and leakage emergency treatment equipment to prevent accidents on the way. The handling process should be light and unloaded to avoid damage to the container due to severe impact.
Operators must also take protective measures. During storage and transportation, relevant personnel should wear suitable protective equipment, such as gas masks, protective gloves and protective clothing, to prevent physical damage caused by contact with the substance.
In addition, the storage and transportation of this substance should also be strictly controlled. Do not exceed the amount of storage and transportation to avoid serious consequences in the event of an accident. No matter whether it is stored or transported, it must be clearly marked, indicating its characteristics and hazards, so that relevant personnel can know and prepare for it.
What are the effects of 1-Fluoro-2-Isothiocyanatobenzene on the environment and human health?
1-Fluorophenyl-2-isothiocyanate is an organic compound. Its impact on the environment and human health cannot be ignored.
In the environment, if this compound is released into the atmosphere, or it is gradually decomposed due to photolysis and other effects. However, its decomposition products may also have adverse effects on the atmospheric environment. If it flows into water bodies, it has certain chemical activities, which may interfere with the balance of aquatic ecosystems. Organisms in water may be poisoned as a result, causing changes in population structure, and may be transmitted through the food chain, amplifying the impact layer by layer. If it enters the soil, or reacts with soil components, it affects the activities of soil microorganisms, which in turn hinders plant growth and development.
As for human health, phenyl 1-fluoro-2-isothiocyanate is irritating. If exposed to the human body, whether it is skin contact or inhalation of its volatile gas, it can cause discomfort. Skin contact may cause redness, swelling, itching and even burns. Inhalers may feel tingling in the respiratory tract, causing coughing, asthma and other symptoms, and even damage lung function. If ingested accidentally, it can cause serious damage to the digestive system, such as burning the mouth, esophagus and stomach, causing nausea, vomiting, abdominal pain and other symptoms. Long-term exposure to this compound environment may increase the risk of cancer, which is life-threatening due to its structural properties or cell abnormalities. Therefore, such compounds should be handled with caution to prevent them from causing serious harm to the environment and human health.