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BETA-HYDROXY-4-(METHYLSULFONYL)-PHENYLALANINE ETHYL ESTER is a chemical compound characterized by the presence of a beta-hydroxy group, a methylsulfonyl group, and a phenylalanine ethyl ester group. It is known for its unique structure and properties, which make it a valuable component in the synthesis of pharmaceuticals and research chemicals.

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  • 100483-39-4 Structure
  • Basic information

    1. Product Name: BETA-HYDROXY-4-(METHYLSULFONYL)-PHENYLALANINE ETHYL ESTER
    2. Synonyms: BETA-HYDROXY-4-(METHYLSULFONYL)-PHENYLALANINE ETHYL ESTER;D-P-METHYISUIFINO PHENYL ETHYL SERINATE
    3. CAS NO:100483-39-4
    4. Molecular Formula: C12H17NO5S
    5. Molecular Weight: 287.33
    6. EINECS: N/A
    7. Product Categories: N/A
    8. Mol File: 100483-39-4.mol
  • Chemical Properties

    1. Melting Point: N/A
    2. Boiling Point: 515°Cat760mmHg
    3. Flash Point: 265.2°C
    4. Appearance: /
    5. Density: 1.309g/cm3
    6. Vapor Pressure: 1.98E-11mmHg at 25°C
    7. Refractive Index: 1.554
    8. Storage Temp.: N/A
    9. Solubility: N/A
    10. CAS DataBase Reference: BETA-HYDROXY-4-(METHYLSULFONYL)-PHENYLALANINE ETHYL ESTER(CAS DataBase Reference)
    11. NIST Chemistry Reference: BETA-HYDROXY-4-(METHYLSULFONYL)-PHENYLALANINE ETHYL ESTER(100483-39-4)
    12. EPA Substance Registry System: BETA-HYDROXY-4-(METHYLSULFONYL)-PHENYLALANINE ETHYL ESTER(100483-39-4)
  • Safety Data

    1. Hazard Codes: N/A
    2. Statements: N/A
    3. Safety Statements: N/A
    4. WGK Germany:
    5. RTECS:
    6. HazardClass: N/A
    7. PackingGroup: N/A
    8. Hazardous Substances Data: 100483-39-4(Hazardous Substances Data)

100483-39-4 Usage

Uses

Used in Pharmaceutical Synthesis:
BETA-HYDROXY-4-(METHYLSULFONYL)-PHENYLALANINE ETHYL ESTER is used as an intermediate in the synthesis of various pharmaceuticals for its potential role in the development of new drugs and treatments.
Used in Research Chemicals:
BETA-HYDROXY-4-(METHYLSULFONYL)-PHENYLALANINE ETHYL ESTER serves as a research chemical, contributing to the advancement of scientific knowledge and understanding of its properties and potential applications.
Used in Organic Chemistry Reactions:
BETA-HYDROXY-4-(METHYLSULFONYL)-PHENYLALANINE ETHYL ESTER is utilized as a reagent in organic chemistry reactions, facilitating the formation of more complex organic molecules.
Used in the Preparation of Complex Organic Molecules:
As a building block, BETA-HYDROXY-4-(METHYLSULFONYL)-PHENYLALANINE ETHYL ESTER is employed in the preparation of intricate organic molecules, showcasing its versatility in the field of chemistry.

Check Digit Verification of cas no

The CAS Registry Mumber 100483-39-4 includes 9 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 6 digits, 1,0,0,4,8 and 3 respectively; the second part has 2 digits, 3 and 9 respectively.
Calculate Digit Verification of CAS Registry Number 100483-39:
(8*1)+(7*0)+(6*0)+(5*4)+(4*8)+(3*3)+(2*3)+(1*9)=84
84 % 10 = 4
So 100483-39-4 is a valid CAS Registry Number.
InChI:InChI=1/C12H17NO5S/c1-3-18-12(15)10(13)11(14)8-4-6-9(7-5-8)19(2,16)17/h4-7,10-11,14H,3,13H2,1-2H3

100483-39-4Relevant articles and documents

DL-p-methylsulfonylphenyl serine ethyl ester preparation method

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Paragraph 0020-0038, (2020/02/29)

The invention discloses a DL-p-methylsulfonylphenyl serine ethyl ester preparation method, which comprises: 1) adding glycine ethyl ester hydrochloride into ethanol, and carrying out heating reflux; 2) dissolving basic cupric carbonate in ammonia water, and adding into the solution obtained in the step 1); 3) adding KOH into the solution obtained in the step 2) to adjust the pH value of the solution, and adding p-methylsulphonyl benzaldehyde, carrying out a reaction; and 4) after the reaction is finished, recovering ethanol in the reacted substance, adding ammonia water into the residue, regulating the pH value, cooling the solution, filtering, washing with ice water, and drying to obtain the p-methylsulfonylphenyl serine ethyl ester. According to the invention, the target product is generated by carrying out a one-step reaction on glycine ethyl ester hydrochloride and p-methylsulphonyl benzaldehyde under the catalysis of basic cupric carbonate and an alkali, wherein the reaction process does not require the use of concentrated sulfuric acid so as to completely avoid the generation of strong acid wastewater, protect and the environment, avoid the possible danger in the sulfuric acid transportation and production process, achieve the safety and easily improve the operation efficiency.

Synthesis method of D-p-methylsulfonylphenyl serine ethyl ester

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Paragraph 0008-0009, (2020/01/25)

The invention discloses a synthesis method of D-p-methylsulfonyl phenyl serine ethyl ester. The method comprises the following steps: preparing p-methylsulfonylphenylserine copper by taking p-methylsulfonylbenzaldehyde, copper sulfate and glycine as main raw materials; then adding anhydrous ethanol and concentrated sulfuric acid into an esterification reaction kettle, carrying out heating for a reaction, filtering out copper sulfate while the solution is hot, carrying out cooling for crystallizing, and carrying out filtering to obtain DL p-methylsulfonylphenyl serine ethyl ester sulfate, dissolving the DL p-methylsulfonylphenyl serine ethyl ester sulfate into water, removing copper ions by using a saturated sodium sulfide solution, adding an alkali into the mother solution for dissociationto obtain DL p-methylsulfonylphenyl serine ethyl ester, and adding a resolving agent for resolving to obtain a product. The method is simple in process, high in yield, low in cost and small in environmental pollution and is suitable for enterprise production.

P-Methyl sulfone phenyl ethyl serinate and synthetic method thereof

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Paragraph 0017; 0040; 0045-0059, (2018/09/12)

The invention discloses a synthetic method of P-methyl sulfone phenyl ethyl serinate, comprising the steps of S1, adding ethyl glycinate hydrochloride into methanol, and heating to dissolve to form afirst solution; S2, adding copper sulfate pentahydrate in the first solution to form a second solution by dissolving; S3, adjusting PH value of the second solution to meet the condition for alkaline reaction, adding P-methylsufonyl benzaldehyde to allow reaction, and holding the temperature and controlling the PH value to keep reaction condition values during reaction; S4, recycling methanol in the reacted materials, adding water to the residue to form a third solution, cooling, and centrifugally separating to obtain P-methyl sulfone phenyl ethyl serinate. The ethyl glycinate hydrochloride andP-methylsufonyl benzaldehyde are subjected to further reaction under the catalytic action of copper sulfate and an organic base to generate a target product; no sulfuric acid is used in the reactionprocess, the amount of waste acid in waste water is decreased, and the environment is protected; dangers that may occur during sulfuric acid transport and production are avoided, better safety is provided, and operating efficiency can be improved.

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