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What is the chemical structure of (1S, 2R) -2-Fluorocyclopropanamine 4-Methylbenzenesulfonate?
(1S, 2R) -2-fluorocyclopropane-4-methylbenzene sulfonate is an organic compound. Its chemical structure is derived from the cyclopropane core skeleton, and the specific position of the substituent on the cyclopropane gives it unique chemical properties.
The cyclopropane structure is like a three-membered ring composed of three carbon atoms, which is strong and has a special spatial configuration. In the (1S, 2R) -2-fluorocyclopropane part, there are specific stereoconfigurations of the substituents at the 1st and 2nd positions of the cyclopropane, respectively. Position 1 is an amino group (-NH ²), position 2 is a fluorine atom (-F), and the spatial orientations of the two follow the S and R configuration rules, respectively. This stereochemical feature has a profound impact on the activity and reactivity of compounds.
The 4-methylbenzene sulfonate part is based on the benzene ring, and the benzene ring para-position has methyl (-CH 🥰), and the sulfonyl group (-SO 🥰) combines with the amine group to form a salt. The conjugate system of the benzene ring endows this part with stability and electronic effects. The methyl group is the power supply group, which can affect the electron cloud density of the benzene ring, and then affect the physical and chemical properties of the whole compound. The chemical structure of (1S, 2R) -2-fluorocyclopropylamine 4-methylbenzenesulfonate combines the unique rigidity of cyclopropane, the specific three-dimensional orientation of fluorine and amino groups, and the electronic effect of benzenesulfonate, which may have important application value in the fields of organic synthesis and medicinal chemistry.
What are the main uses of (1S, 2R) -2-Fluorocyclopropanamine 4-Methylbenzenesulfonate?
(1S, 2R) -2 -fluorocyclopropylamine 4-methylbenzene sulfonate, an organic compound. Its main uses are quite extensive, and it is often used as a key intermediate in the field of medicinal chemistry. Due to its unique structure, it can participate in many drug synthesis reactions and help create drug molecules with specific biological activities.
In the field of organic synthesis, this compound can be used as a cornerstone for the construction of complex cyclic structures due to its special chemical properties. With its fluorine and amine-containing active groups, it can be cleverly connected with other organic molecules through various chemical reactions, such as nucleophilic substitution, condensation, etc., to expand the complexity and diversity of molecules.
In the field of materials science, it also has potential application value. It may be chemically modified to introduce specific functional groups, endowing materials with novel physical and chemical properties, such as improving the solubility, stability or optical properties of materials, which contribute to the research and development of new functional materials.
In summary, (1S, 2R) -2 -fluorocyclopropylamine 4-methylbenzene sulfonate has shown important application prospects in many scientific fields, providing strong support for the progress of drug development, organic synthesis and materials science.
What is the synthesis method of (1S, 2R) -2-Fluorocyclopropanamine 4-Methylbenzenesulfonate
The synthesis of (1S, 2R) -2-fluorocyclopropane amine 4-methylbenzenesulfonate is a crucial research in organic synthesis chemistry. To obtain this compound, there are many ways to go.
First, it can be initiated by a cyclopropane derivative with a specific configuration. First, a suitable cyclopropane raw material is taken, and the fluorine atom is introduced at a specific position through a halogenation reaction to precisely construct the cyclopropane structure containing fluorine. This halogenation reaction requires careful selection of halogenating reagents and reaction conditions, such as the use of specific fluorinating reagents and the reaction in a suitable temperature and solvent environment, to ensure that the fluorine atoms are introduced according to the expected (1S, 2R) configuration.
Then, fluorine-containing cyclopropane is aminated. This step can be achieved by a nucleophilic substitution reaction. Under the catalysis of a suitable base, a suitable amination reagent interacts with fluorocyclopropane to promote the amine group to replace the group at a specific position, thereby forming (1S, 2R) -2-fluorocyclopropane amine. In this process, the type and dosage of bases, as well as the reaction temperature, time and other factors have a huge impact on the yield and selectivity of the reaction, which needs to be carefully regulated.
Furthermore, to obtain (1S, 2R) -2-fluorocyclopropane amine 4-methylbenzenesulfonate, the resulting (1S, 2R) -2-fluorocyclopropane amine needs to be salt-formed with 4-methylbenzenesulfonic acid. In a suitable solvent, mix the two according to the appropriate molar ratio, stir and react for a certain period of time to obtain the target product. After the reaction is completed, it needs to be separated and purified, such as recrystallization, column chromatography and other means, in order to obtain high-purity (1S, 2R) -2-fluorocyclopropane amine 4-methylbenzene sulfonate.
The whole process of synthesis, the control of the reaction conditions, the purification of the intermediate and the maintenance of the configuration are all the keys to the successful preparation of the target compound. The experimenter needs to have exquisite skills and profound chemical knowledge, and careful operation can be achieved.
What are the physical properties of (1S, 2R) -2-Fluorocyclopropanamine 4-Methylbenzenesulfonate?
(1S, 2R) -2-fluorocyclopropylamine 4-methylbenzene sulfonate, which is a compound in the field of organic chemistry. Its physical properties are quite critical and are related to many practical applications.
Looking at its morphology, it is mostly in the state of white to off-white crystalline powder at room temperature and pressure. This morphological characteristic is easy to store and transport. Because it is relatively stable, it is not easy to undergo significant physical changes in conventional environments.
When it comes to the melting point, the melting point of this compound is within a specific range, between [X] ° C and [X] ° C. The characteristics of the melting point are of great significance in the identification and purity determination of compounds. If the melting point is consistent with the established standard and the melting range is narrow, it often indicates that the purity of the compound is quite high; conversely, if the melting point is deviated or the melting range is too wide, it indicates that it may contain impurities.
Solubility is also an important physical property. In organic solvents, such as methanol, ethanol and other common alcoholic solvents, (1S, 2R) -2-fluorocyclopropylamine 4-methylbenzene sulfonate exhibits good solubility, which makes it easier to dissolve it in a suitable solvent to meet the reaction or formulation requirements during chemical synthesis operations or preparation. However, the solubility in water is relatively limited, which determines that its use should be carefully considered in application scenarios involving aqueous phase systems.
In addition, the density of this compound also has a specific value, which is about [X] g/cm ³. The density data is extremely important for accurate measurement and simulation of related physical processes, and can provide an accurate quantification basis for actual operation.
In summary, the physical properties of (1S, 2R) -2-fluorocyclopropylamine 4-methylbenzenesulfonate, such as morphology, melting point, solubility and density, play a decisive role in its application in many fields such as organic synthesis and drug development. In-depth understanding of these properties can be better used.
What is the price range of (1S, 2R) -2-Fluorocyclopropanamine 4-Methylbenzenesulfonate in the market?
I don't know what the price range of (1S, 2R) -2 -fluorocyclopropylamine 4 -methylbenzenesulfonate is in the market. This compound may be a rare product, and its price is often determined by many factors.
The raw material is difficult to obtain. If the raw material is rare, difficult to collect, or requires complicated processes to obtain, the cost will be high, and its price will also rise. The simplicity of the preparation process is also the key. If the synthesis process requires multiple steps of reaction, and each step requires precise operation, harsh conditions, and special reagents or instruments are required, the process cost will increase greatly, and the price will not be low.
The supply and demand situation of the market. If there is a large demand for this product, but the supply is scarce, and everyone is competing to buy it, the price will rise; conversely, if the demand is small and the supply is sufficient, the price will be easy to drop. In addition, the number of manufacturers and the competition situation also affect. If there are many manufacturers and the competition is intense, the price may become reasonable; if the manufacturers are less close to monopoly, the price will be very high.
However, because I cannot obtain detailed market information, it is difficult to determine the price range. For details, you can consult the chemical product trading platform, relevant raw material suppliers, or those who specialize in the industry to get a more accurate price range.