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Benzene, 1-Fluoro-3-Isothiocyanato-

Benzene, 1-Fluoro-3-Isothiocyanato-

Hongda Chemical

Specifications

HS Code

574613

Chemical Formula C7H4FNS
Molar Mass 153.176 g/mol
Odor Pungent, due to isothiocyanate group
Solubility In Water Low, as it is non - polar with some polar groups
Solubility In Organic Solvents Soluble in many organic solvents like dichloromethane, chloroform
Stability Can react with nucleophiles due to isothiocyanate group, relatively reactive

As an accredited Benzene, 1-Fluoro-3-Isothiocyanato- factory, we enforce strict quality protocols—every batch undergoes rigorous testing to ensure consistent efficacy and safety standards.

Packing & Storage
Packing 100 - gram vial of 1 - fluoro - 3 - isothiocyanato - benzene, well - sealed for chemical storage.
Storage 1 - fluoro - 3 - isothiocyanatobenzene should be stored in a cool, dry, well - ventilated area, away from heat sources and ignition points. Keep it in a tightly sealed container to prevent leakage. As it is a potentially hazardous chemical, store it separately from incompatible substances like oxidizing agents, acids, and bases, in accordance with safety regulations.
Shipping The chemical "Benzene, 1 - fluoro - 3 - isothiocyanato -" is likely shipped in sealed, corrosion - resistant containers. Special care is taken due to its chemical nature, following strict regulations for hazardous chemicals during transit.
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Benzene, 1-Fluoro-3-Isothiocyanato- Benzene, 1-Fluoro-3-Isothiocyanato-
General Information
Historical Development
The historical evolution of 1-fluoro-3-isothiocyanate phenyl ester
Taste the field of chemical industry, the formation and development of 1-fluoro-3-isothiocyanate phenyl ester (Benzene, 1-Fluoro-3-Isothiocyanato -) has undergone changes over time. In the past, chemical experts have continuously explored the way of organic synthesis, and strived to expand the variety and application of compounds.
At first, the organic synthesis technology was still simple, but the introduction of fluorine-containing and isothiocyanate radical groups was difficult. However, chemists were tenacious and gradually mastered the specific reaction conditions through repeated experiments. With the passage of time, the reaction process has been improved day by day, and the yield and purity have been improved.
This compound was initially or only a novel product in the laboratory. Later, due to its unique chemical properties, it rose to prominence in the fields of medicine, materials, etc., attracting more researchers to devote themselves to research. Its development then entered the fast lane and eventually became an important branch of chemical research today.
Product Overview
About the product overview of 1-fluoro-3-isothiocyanate
There is a chemical substance named 1-fluoro-3-isothiocyanate phenyl ester, its English name is "Benzene, 1-Fluoro-3-Isothiocyanato-". This substance has unique chemical properties. From a structural perspective, on the benzene ring, fluorine atoms are cleverly connected to isothiocyanate radical groups to construct a specific spatial structure.
In the application field, it is quite active in the stage of organic synthesis. It can be used as a key intermediate to help synthesize many organic compounds with special functions. For example, in the process of new drug development, it may contribute to the creation of specific active ingredients; in the field of materials science, it may also participate in the preparation of new materials with excellent performance.
When using it, be careful. Due to its chemical properties, there may be certain latent risks. When operating, safety procedures must be strictly followed to prevent accidents and ensure the safety of people and the environment.
Physical & Chemical Properties
1-Fluoro-3-isothiocyanate benzene (Benzene, 1-Fluoro-3-Isothiocyanato -) is a chemical substance. Its physical properties, clear in color and different in taste, are often liquid, at room temperature, with a certain volatility. Its density is slightly lighter than that of water, and it is insoluble in water, but it can be mixed with various organic solvents.
In terms of its chemical properties, the existence of fluorine atoms and isothiocyanate makes it highly active. It can react with many nucleophilic reagents, such as alcohols, amines, etc., to form different compounds. Isothiocyanate can be nucleophilic added with those containing active hydrogen to derive new structures. In the field of organic synthesis, this compound is often a key intermediary, assisting in the creation of many complex organic molecules, and has potential applications in the research and development of medicines and pesticides.
Technical Specifications & Labeling
Today there is a product named "Benzene, 1 - Fluoro - 3 - Isothiocyanato -". It is crucial to study the process specifications and identification (product parameters).
Looking at this substance, it is necessary to review its process specifications in detail. From the selection of raw materials, it is necessary to be pure and flawless, and impurities can cause changes in properties at all. The preparation method requires precise steps. The parameters of temperature and pressure must be in line with the law. If there is a slight difference, the product will not be in the expected state.
Identification (product parameters) should not be ignored. Its chemical structure, purity geometry, physical properties, such as melting point, boiling point, etc., should be clearly marked. This can provide a basis for users to judge whether its quality is good or bad, and whether it is suitable for use.
For our chemical researchers, gaining insight into the process specifications and labels (product parameters) of this product is the key to unlocking its secrets and making good use of it.
Preparation Method
To prepare 1-fluoro-3-isothiocyanate benzene (Benzene, 1-Fluoro-3-Isothiocyanato -), the method is as follows:
Raw materials and production process: Take an appropriate amount of fluorobenzene as the starting material, supplemented by sulfur phosgene, sodium cyanide and other reagents. In a suitable reaction vessel, ensure that the reaction environment is pure.
Reaction steps: First mix fluorobenzene and sulfur phosgene in a certain proportion, heat it at controlled temperature, promote its substitution reaction, and generate sulfur-containing intermediates. Then slowly add sodium cyanide and continue to stir. In this step, pay attention to the regulation of the reaction conditions to make the reaction proceed smoothly.
Catalytic mechanism: Specific organic bases can be used as catalysts to improve the reaction rate and product selectivity. Organic bases can effectively reduce the activation energy of the reaction, promote the reaction to proceed along the desired path, and improve the yield and purity of 1-fluoro-3-isothiocyanate benzene. The entire preparation process requires fine operation and close monitoring of all links to achieve the desired effect.
Chemical Reactions & Modifications
Today there is a thing called "Benzene, 1 - Fluoro - 3 - Isothiocyanato-". In the field of chemistry, its reaction and modification are quite important.
Looking at this compound, the position of fluorine and isothiocyanate makes it have unique chemical properties. When it reacts, fluorine atoms are active and easily interact with nucleophiles, and isothiocyanate can also cause various reactions. The two affect each other and cause various reaction pathways.
If you want to modify it, you can use chemical means to change its substituents or adjust the reaction conditions. In this way, its physical and chemical properties may be changed to make it suitable for more uses. Chemists study this approach with the hope of precisely regulating its reactions and modifications, contributing to the advancement of chemistry and industry.
Synonyms & Product Names
The style of "Mengxi Bi Tan" is based on the facts and reasons. It is imitated today. On the synonym and business name of "Benzene, 1 - Fluoro - 3 - Isothiocyanato -".
"Benzene, 1 - Fluoro - 3 - Isothiocyanato -" is also a chemical thing. There are many synonyms, which vary according to the research of scholars and the differences in regions. In the academic world, each family's appellation has its own origin, or according to its structure, or according to its characteristics. As for the business name, it is related to production and sales, in order to promote its use and facilitate its sale.
The synonyms of this substance are all named after its chemical nature, or the arrangement of its atoms, or the group of its faculties. The business name depends on the needs of the merchant to sell the market and the needs of the customer, and wants to show its advantages to attract the attention of the public. Although the synonyms are different from the business names, they all refer to this substance, each has its own use, and it cannot be ignored for research and sale.
Safety & Operational Standards
Code of Safety and Operation of Phenyl Monofluoro-3-isothiocyanate
Phenyl monofluoro-3-isothiocyanate (Benzene, 1-Fluoro-3-Isothiocyanato-) is a common substance in chemical research. During its experimental operation and research process, safety and operation standards are of the utmost importance and must not be ignored.
#1. Storage Rules
This substance should be placed in a cool, dry and well-ventilated place. Keep away from fire and heat sources to prevent accidents. Store it separately from oxidants, acids, bases, etc., and must not be mixed to avoid chemical reactions and danger. The container must be tightly sealed to prevent leakage. Regularly check the storage facilities to ensure that there is no risk of damage or leakage.
#2. The essentials of operation
When operating, the experimenter should wear appropriate protective clothing, protective gloves and goggles to protect themselves. The operating environment needs to be well ventilated, and it is best to carry out it in a fume hood to avoid the accumulation of its volatile gases. When using this substance, the action should be slow to prevent spillage. In the event of spillage, proper measures should be taken to clean it up immediately. If a small amount of spillage occurs, it can be absorbed by inert materials such as sand and vermiculite; if the amount is large, the personnel should be evacuated quickly, and the warning area should be demarcated and handled by professionals.
#3. Emergency measures
If you accidentally come into contact with the skin, you should immediately remove the contaminated clothes, rinse with a large amount of flowing water for at least 15 minutes, and then seek medical attention. If it splashes into the eyes, immediately lift the eyelids, rinse with flowing water or normal saline, and seek medical attention in time. If you inhale its volatile gas, quickly transfer it to a fresh air place to keep the respiratory tract unobstructed. If breathing difficulties, give oxygen. If breathing stops, immediately perform artificial respiration and seek medical attention.
In short, in the research and use of phenyl monofluoride-3-isothiocyanate, strictly abide by safety and operating standards to ensure smooth experiments and personnel safety.
Application Area
Benzene (1 - Fluoro - 3 - Isothiocyanato) has a wide range of application fields. In the field of medicinal chemistry, it may participate in the creation of new drugs with its unique structure. Because of its fluorine and isothiocyanate functional groups, fluorine atoms can regulate the lipid solubility and metabolic stability of drug molecules, and isothiocyanate may interact with specific targets of biological macromolecules, helping to develop highly active and specific drugs.
In the field of materials science, it can be used as a key intermediate in the synthesis of functional materials. Based on it, through specific reactions, materials with special optical and electrical properties may be prepared for use in optoelectronic devices, sensors and other fields. Such as reacting with compounds containing specific functional groups to construct conjugated systems to adjust the photoelectric properties of materials to meet different application requirements.
Research & Development
I am committed to the study of chemical substances, and recently focused on the substance "Benzene, 1 - Fluoro - 3 - Isothiocyanato -".
At the beginning of the research, investigate its molecular structure in detail, explore the wonder of its atomic arrangement, and understand its chemical bonding method. Also study the physical properties of this substance, such as melting point and boiling point, to know its state at room temperature.
Next, study its chemical properties. Observe its reaction with various reagents, study the reaction mechanism, and hope to clarify its role in various chemical processes.
This substance may have potential uses in industry and scientific research. Or it can be used as a raw material for synthesizing new compounds and open up new avenues for chemical synthesis.
However, the road to research is full of thorns. It is difficult to accurately determine the reaction conditions and control the purity of the product. I will study diligently, hoping to make breakthroughs, promote the research and development of this substance, and contribute to the field of chemistry.
Toxicity Research
The toxicity of this substance is related to living things and cannot be ignored. Today there is a compound named "Benzene, 1 - Fluoro - 3 - Isothiocyanato -", and we should study it in detail.
The toxicity of this substance is related to health and cannot be ignored. Or it has various effects on the body of living things. However, the depth and breadth of toxicity can only be clarified by precise methods and detailed tests.
If you want to study the toxicity of this substance, you should start from multiple sources. Observe its exposure to different environments, its response to other objects, and observe the changes it makes when it enters the body of living things. During the experiment, record its images in detail and investigate its reasons in detail.
After all kinds of research, I hope to know the secret of toxicity of "Benzene, 1 - Fluoro - 3 - Isothiocyanato -". I think that when the world uses this product, it avoids harm and seeks profit, and protects the safety of life and the environment. In this way, it will live up to our generation's desire to explore toxicity.
Future Prospects
I have dedicated myself to the research of chemical industry, and recently focused on "Benzene, 1 - Fluoro - 3 - Isothiocyanato -". Although I don't know much at present, I am full of hope for its future development.
This product may have extraordinary potential in various fields of chemical industry. It is expected that in the future, after repeated research and testing, it will be able to explore its subtlety. Or it can emerge in the way of material synthesis, contributing to the creation of new materials. Or it can help in the development of medicine, becoming a cure for diseases and saving people.
I firmly believe that with time, with unremitting efforts and the cooperation of colleagues, the potential of "Benzene, 1 - Fluoro - 3 - Isothiocyanato -" will be fully stimulated. Make it useful to the world, benefit all people, and achieve a great career, which will live up to our original intention of scientific research.
Where to Buy Benzene, 1-Fluoro-3-Isothiocyanato- in China?
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Frequently Asked Questions

As a leading Benzene, 1-Fluoro-3-Isothiocyanato- supplier, we deliver high-quality products across diverse grades to meet evolving needs, empowering global customers with safe, efficient, and compliant chemical solutions.

What is the chemistry of 1-Fluoro-3-Isothiocyanato-Benzene?
Phenyl 1-fluoro-3-isothiocyanate is one of the organic compounds. It has unique chemical properties.
In this substance, fluorine atoms have strong electronegativity, resulting in uneven distribution of molecular electron clouds, which reduce the density of benzene ring electron clouds and affect their reactivity. Isothiocyanate (- NCS) is also an active functional group.
In nucleophilic substitution reactions, the carbon atoms of isothiocyanate are electrophilic and vulnerable to attack by nucleophilic reagents. In the case of nucleophilic reagents containing active hydrogen, such as alcohols and amines, an addition reaction can occur. React with alcohols or form carbamate derivatives; react with amines to form thioureas.
It can also participate in aromatic electrophilic substitution reactions. Because fluorine atoms are ortho and para-localizers, although the electron cloud density of the benzene ring is reduced, it guides electrophilic reagents to attack the ortho and para-localization of the benzene ring.
Furthermore, 1-fluoro-3-isothiocyanate phenyl ester has certain irritation and toxicity due to its isothiocyanate content. When operating and using, it is necessary to take appropriate protective measures to ensure the safety of experimenters and the environment is not polluted. Its diverse chemical properties make it useful in organic synthesis, medicinal chemistry and other fields, or as a key intermediate for the preparation of a variety of organic compounds with special functions.
What are the physical properties of 1-Fluoro-3-Isothiocyanato-Benzene?
1-Fluoro-3-phenyl isothiocyanate is a key raw material in organic synthesis. This substance has the following physical properties:
Looking at its appearance, under room temperature and pressure, it often takes the form of a colorless to light yellow liquid, with a clear and translucent texture. This form is conducive to uniform dispersion in many reaction systems, full contact with other reactants, and then promote the reaction process.
Smell its odor, the substance emits a pungent and unique odor. This strong odor requires special attention during operation, as it will not only irritate the sense of smell, but also cause physical discomfort in some individuals after prolonged exposure. Therefore, it is necessary to operate in a well-ventilated area, or even need to be equipped with professional protective equipment.
When it comes to solubility, 1-fluoro-3-phenyl isothiocyanate can be soluble in many organic solvents, such as common ether, dichloromethane, chloroform, etc. Good solubility makes it possible to flexibly select suitable solvent systems according to different reaction requirements in organic synthesis reactions, providing convenience for the smooth development of the reaction.
Looking at its boiling point, it is about a specific temperature range (the specific value varies depending on the measurement conditions). The characteristics of the boiling point determine that when separating and purifying the substance, distillation and other means can be used. By precisely controlling the temperature, it can achieve the purpose of separating it from other substances with large boiling points, so as to obtain high-purity products.
Looking at the melting point, it is also in a specific temperature range. The information on the melting point is of great significance in the storage and transportation of substances. Therefore, suitable conditions can be reasonably selected to ensure the stability of its physical state and prevent the change of the state of the substance due to temperature fluctuations, which in turn affects its quality and performance.
The density of 1-fluoro-3-phenyl isothiocyanate is different from that of water (the specific density value depends on the measurement conditions). This density characteristic is particularly important when involving operations such as liquid-liquid separation. The operator can use the density difference to choose a suitable method to achieve efficient separation of the substance from other liquids.
What are the main uses of 1-Fluoro-3-Isothiocyanato-Benzene?
1-Fluorophenyl-3-isothiocyanate is an important compound in organic chemistry. It has a wide range of uses and has been demonstrated in many fields.
First, in the field of medicinal chemistry, it plays a key role. In the process of many drug development, 1-fluorophenyl-3-isothiocyanate can act as a key intermediate. With its special chemical structure, it can cleverly react with other compounds to construct molecular structures with specific biological activities. For example, in the synthesis of some anti-cancer drugs, this compound will be used to shape drug molecules that can effectively act on cancer cells through precise chemical reactions, helping to solve cancer problems.
Second, in the field of materials science, it also has outstanding performance. It can be used to prepare polymer materials with special properties. By polymerizing with specific monomers, the material is endowed with unique properties, such as enhancing the stability of the material and improving its optical properties. This is of great significance in the manufacture of high-performance plastics, optical fibers and other materials, which can improve the quality and performance of materials and meet the needs of different scenarios.
Third, in the field of organic synthesis, 1-fluoro-3-isothiocyanate phenyl ester is a very commonly used reagent. Because it contains isothiocyanate groups and fluorine atoms with high reactivity, it can participate in various types of organic reactions, such as nucleophilic substitution reactions, addition reactions, etc. This allows chemists to ingeniously design and synthesize complex organic molecules, contributing to the development of organic synthetic chemistry and promoting the creation and research of new compounds.
What are 1-Fluoro-3-Isothiocyanato-Benzene synthesis methods?
The synthesis methods of 1-fluoro-3-isothiocyanate phenyl ester have been different throughout the ages. The methods include benzene as the starting material and obtained through various reactions.
First, benzene is used as the base, and fluorine atoms are introduced into the benzene ring by halogenation to obtain fluorobenzene. This halogenation technique, or using a specific halogenation reagent, under the conditions of suitable temperature, pressure and catalyst, makes the fluorine atom precisely replace the hydrogen atom on the benzene ring.
Fluorobenzene is obtained, and then the nitration reaction is carried out. Choose an appropriate nitrification reagent to control the reaction conditions, so that the nitro group is introduced into the specific position of the fluorobenzene to obtain fluorine-containing nitrobenzene. This step requires detailed observation of the reaction conditions to ensure that the nitro group enters accurately. Due to the difference in location, it has a great impact on the subsequent reaction and the properties of the product.
Then, fluorine-containing nitrobenzene is reduced. With a suitable reducing agent, in a suitable environment, the nitro group is converted to an amino group to obtain fluoroaniline. There are many reduction methods, and the reducing agents used are also different. It is necessary to choose carefully according to the actual situation.
Finally, fluoroaniline reacts with sulfur phosgene or other suitable thiocyanation reagents, and undergoes complex chemical changes to obtain 1-fluoro-3-isothiocyanate phenyl ester. This step of the reaction has strict requirements on the reaction conditions such as temperature, time, and the proportion of reactants. Slightly poor pools may cause the product to be impure or the yield to be low.
There are also other methods, starting from different starting materials and going through different reaction paths, this target product can also be achieved. However, no matter what method, it is necessary to study the reaction mechanism carefully and observe the reaction conditions in detail to obtain pure and high-yield 1-fluoro-3-isothiocyanate phenyl ester.
What are the precautions in storage and transportation of 1-Fluoro-3-Isothiocyanato-Benzene?
1-Fluorophenyl-3-isothiocyanate is a chemical substance. When storing and transporting, it is necessary to be careful and take various precautions not to be ignored.
When storing it, the first environment. It is advisable to choose a cool, dry and well-ventilated place, away from fire and heat sources. This is because it has a certain chemical activity, high temperature or can cause reactions, causing danger. And because it may be sensitive to air and moisture, it should be sealed and stored to prevent deterioration. If stored in an improper environment, such as a humid place, or causing reactions such as hydrolysis, its quality will be damaged.
Times and containers. Storage containers used should be chemically resistant. 1-Fluorophenyl-3-isothiocyanate can react with some materials, so a container of suitable materials, such as glass or specific plastic materials, must be used to ensure its chemical stability and not interact with the container, so as not to leak or affect its chemical properties.
As for transportation, safety comes first. Transportation vehicles must be equipped with corresponding fire fighting equipment and leakage emergency treatment equipment. During transportation, be sure that the container does not leak, collapse, fall, or damage. And do not mix with oxidants, acids, alkalis, etc., because 1-fluoro-3-isothiocyanate phenyl ester meets with their substances, or reacts violently, endangering transportation safety.
Furthermore, transportation personnel should also be professionally trained to be familiar with the nature of the chemical and emergency treatment methods. If there is an accident such as a leak during transportation, effective measures can be taken quickly to reduce the harm. In the event of a leak, the surrounding people should be evacuated immediately and the leakage area should be isolated. Emergency personnel must wear protective equipment to properly collect or dispose of the leak to prevent the expansion of pollution.