R 4 4 Dimethylamino 1 4 Fluorophenyl 1 Hydroxybutyl 3 Hydroxymethyl Benzonitrile
Fluorine Difluoride Fluorobenzene Fluorobenzyl Trifluorotoluene
(R)-4-(4-dimethylamino)-1-(4-fluorophenyl)-1-hydroxybutyl)-3-(hydroxymethyl)benzonitrile
Chemical Name (R)-4-(4-dimethylamino)-1-(4-fluorophenyl)-1-hydroxybutyl)-3-(hydroxymethyl)benzonitrile
Molecular Formula C20H23FN2O2
Molecular Weight 342.41
Appearance Typically a solid (physical state may vary based on purity and preparation)
Melting Point Specific value would require experimental determination
Boiling Point Specific value would require experimental determination
Solubility Solubility characteristics depend on solvents, likely has some solubility in polar organic solvents
Pka Values for acidic and basic groups would need experimental determination
Logp Describes lipophilicity, value would need experimental determination
Stereochemistry Has (R)-configuration at a chiral center
Uv Vis Absorption Absorption maxima would depend on chromophores in the molecule, need spectroscopic determination
Chemical Formula C20H23FN2O3
Molecular Weight 358.41
Chemical Name (R)-4-(4-dimethylamino)-1-(4-fluorophenyl)-1-hydroxybutyl)-3-(hydroxymethyl)benzonitrile
Molecular Formula C20H23FN2O2
Molecular Weight 342.41 g/mol
Chemical Name (R)-4-(4-dimethylamino)-1-(4-fluorophenyl)-1-hydroxybutyl)-3-(hydroxymethyl)benzonitrile
Molecular Formula C20H23FN2O2
Molecular Weight 342.41 g/mol
Appearance Solid (predicted)
Boiling Point Predicted high boiling point due to hydrogen - bonding and polar groups
Solubility Soluble in polar organic solvents like methanol, ethanol; less soluble in non - polar solvents
Density Predicted density based on similar compounds in the range of 1.1 - 1.3 g/cm³
Logp Value indicating lipophilicity, predicted based on hydrophobic and hydrophilic moieties
FAQ

What is the chemical structure of (R) -4- (4-dimethylamino) -1- (4-fluorophenyl) -1-hydroxybutyl) -3- (hydroxymethyl) benzonitrile?

This is the name of an organic compound, and its chemical structure can be summarized as follows.

The name of this compound has been resolved, and its core structure contains a benzonitrile part, that is, a cyanyl group (\ (-CN\)) attached to the benzene ring. The 3-position of the benzene ring is connected with hydroxymethyl (\ (- CH_2OH\)).

There is a fluorophenyl group at the 1-position, that is, 4-fluorophenyl (\ (- C_6H_4F\)), and this phenyl group is connected to a hydroxyl-containing butyl chain, and the 1-position of this butyl chain has a hydroxyl group (\ (-OH\)).

Furthermore, the 4-position of the butyl chain is connected with dimethylamino (\ (-N (CH_3) _2\)). In addition, the 1-position carbon of the butyl chain is chiral and the configuration is (\ (R\)) type.

In summary, the chemical structure of this compound is benzonitrile ring 3-position-linked hydroxymethyl, 1-position is chiral with (\ (R\)) type and 1-position is hydroxyl, 4-position is connected to 4-fluorophenyl with dimethylamino butyl chain. Its structure is composed of phenyl ring, cyano group, hydroxymethyl group, fluorophenyl group, butyl chain with hydroxyl group and dimethylamino group, etc. Each part is connected with the configuration in a specific order to form the unique chemical structure of this organic compound.

What are the main uses of (R) -4- (4-dimethylamino) -1- (4-fluorophenyl) -1-hydroxybutyl) -3- (hydroxymethyl) benzonitrile?

(R) -4- (4-dimethylamino) -1- (4-fluorophenyl) -1-hydroxybutyl) -3- (hydroxymethyl) benzonitrile has a wide range of uses. In the field of medicine, it is often the key raw material for the creation of new drugs. Because of its unique chemical structure, specific biological activity, it can combine with specific targets in organisms, or regulate physiological processes, or intervene in pathological mechanisms, so in the process of drug development, it is valued by researchers and hoped to become an effective drug for the treatment of specific diseases.

In the field of organic synthesis, this compound is also an important intermediate. With its diverse reaction check points, it can construct more complex organic molecular structures through various organic reactions, such as substitution, addition, oxidation and reduction, etc., to help organic synthesis chemists achieve the synthesis of specific structural and functional organic compounds, providing strong support for the development of materials science, total synthesis of natural products and many other fields.

Furthermore, in biochemical research, (R) -4- (4-dimethylamino) -1- (4-fluorophenyl) -1-hydroxybutyl) -3- (hydroxymethyl) benzonitrile can be used as a tool molecule for exploring specific biochemical reaction pathways, protein-ligand interactions, etc., to help scientists clarify the molecular mechanism of life activities, and then contribute to the basic research of life science.

What are the synthesis methods of (R) -4- (4-dimethylamino) -1- (4-fluorophenyl) -1-hydroxybutyl) -3- (hydroxymethyl) benzonitrile?

The synthesis method of (R) -4- (4-dimethylamino) -1- (4-fluorophenyl) -1-hydroxybutyl) -3- (hydroxymethyl) benzonitrile has always been studied by chemical experts. There are many methods, each with its own ingenuity.

One method starts with fluorobenzaldehyde and reacts with enol ethers with specific structures in an acid-catalyzed environment. The resulting intermediates can be obtained by reducing the key alcohols. This alcohol is then reacted with a halogenated hydrocarbon containing a cyanide group with appropriate substituents, with the help of a base, through nucleophilic substitution, and the target (R) -4- (4-dimethylamino) -1- (4-fluorophenyl) -1-hydroxybutyl) -3- (hydroxymethyl) benzonitrile can be obtained.

Another method is to use 4-fluoroacetophenone as a group, first condensate with dimethylaminoacetaldehyde to obtain an enamine intermediate. After catalytic hydrogenation, the enamines are partially reduced. After the introduction of hydroxymethyl groups, and then the cyanidation step, the compound can also be obtained. During operation, the hydrogenation conditions, the order of introducing groups, and the dosage of reagents must be carefully controlled to achieve optimum results.

Another method based on asymmetric synthesis, a system composed of chiral ligands and metal catalysts is selected to catalyze key reaction steps, and the (R) -configuration of the target molecule can be constructed with high selectivity. This approach requires high requirements for the design and screening of chiral ligands and the optimization of reaction conditions, but high-purity products can be obtained, which is also of great value in industrial preparation.

What are the physicochemical properties of (R) -4- (4-dimethylamino) -1- (4-fluorophenyl) -1-hydroxybutyl) -3- (hydroxymethyl) benzonitrile?

(R) - 4 - (4 - dimethylamino) - 1 - (4 - fluorophenyl) - 1 - hydroxybutyl) - 3 - (hydroxymethyl) benzonitrile is also an organic compound. Its physical and chemical properties are quite important, related to the characteristics and applications of this compound.

In terms of its appearance, it may be in the form of a white to light yellow solid powder at room temperature and pressure. This is due to intermolecular forces, which make it exist in a solid state. The texture of the powder is delicate, easy to disperse and handle, and it is quite convenient for experimentation and production operations.

In terms of solubility, this compound may exhibit different solubility characteristics in organic solvents. In polar organic solvents such as methanol and ethanol, it may have a certain solubility. Because its molecular structure contains polar hydroxyl, amino and cyanyl groups, it can form hydrogen bonds or other intermolecular forces with polar organic solvents, so it can be dissolved. However, in non-polar organic solvents such as n-hexane, the solubility may be extremely low, because the force between the non-polar solvent and the polar group of the compound is weak, it is difficult to destroy the interaction between its molecules.

Talking about the melting point, the melting point of (R) -4- (4-dimethylamino) -1- (4-fluorophenyl) -1-hydroxybutyl) -3- (hydroxymethyl) benzonitrile is a specific value. The determination of the melting point can help to identify the purity of the compound. If the purity of the sample is high, the melting point range is narrow and close to the theoretical value; if it contains impurities, the melting point decreases and the melting range becomes wider.

The stability of the compound is discussed again. Under normal environmental conditions, the compound may have certain chemical stability. In case of strong acid, strong base or high temperature, strong oxidizing agent and other special conditions, its molecular structure may be damaged. In case of strong acid, the amino group or protonation in the molecule will cause structural changes; in case of strong oxidizing agent, hydroxyl group and other groups may be oxidized, resulting in changes in the properties of the compound.

And its density, although there is no exact literature, but according to similar compounds, its density may be similar to that of common organic compounds. The characteristics of density also have certain reference value when separating, storing and transporting the compound.

What are the market prospects for (R) -4- (4-dimethylamino) -1- (4-fluorophenyl) -1-hydroxybutyl) -3- (hydroxymethyl) benzonitrile?

(R) - 4 - (4 - dimethylamino) - 1 - (4 - fluorophenyl) - 1 - hydroxybutyl) - 3 - (hydroxymethyl) benzonitrile, a fine chemical, has considerable prospects in today's market.

This compound shows extraordinary potential in the field of pharmaceutical research and development. Due to its unique structure and significant pharmacological activity, it may become a key intermediate for new drugs. Nowadays, many pharmaceutical companies and scientific research institutions are focusing on the development of innovative drugs, and the demand for compounds with specific structures and activities has surged. ( The characteristics of R) -4- (4-dimethylamino) -1- (4-fluorophenyl) -1-hydroxybutyl) -3- (hydroxymethyl) benzonitrile can just meet the needs of some drug research and development, so it is expected to find a wide range in the pharmaceutical intermediate market.

In the field of pesticides, it also has potential. With people's emphasis on the quality of agricultural products and environmental safety, the development of new, efficient and low-toxic pesticides has become the general trend. Some properties of this compound may provide new ideas for the creation of pesticides. If it can be applied rationally, it may give rise to new pesticide products, help agricultural pest control, improve the quality of agricultural products, and then occupy a place in the pesticide raw material market.

Furthermore, in the field of materials science, with the progress of science and technology, the demand for special performance materials is increasing day by day. ( R) - 4 - (4 - dimethylamino) - 1 - (4 - fluorophenyl) - 1 - hydroxybutyl) - 3 - (hydroxymethyl) benzonitrile may be suitably modified for the preparation of materials with special properties, such as optical materials, electronic materials, etc. There are also opportunities for development in the emerging materials market.

However, although the market opportunity is abundant, there are also challenges. Optimization of the synthesis process is a key. More efficient and green synthesis routes need to be developed to reduce production costs and enhance product competitiveness. At the same time, in the face of market competition, it is necessary to strengthen the protection of intellectual property rights and accelerate the process of Product Research & Development in order to stand out in the market and enjoy the bright future.