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benzyl (S)-2-amino-3-(3-(methylsulfonyl)phenyl)propanoate

Basic Information

  • CAS Number 1194550-59-8
  • Molecular Formula :C17H20ClNO4
  • Molucular Weight 369.86
  • Package: 500g/bag, 1kg/bag, 5kg/bag, 10kg/bag, 25kg/drum, or as per customer requirements
  • Storage seale in a light-proof container and store in a cool (2–8℃), dry and well-ventilated place.
  • Retest Period Two Years

product Description

Benzyl (S)-2-amino-3-(3-(methylsulfonyl)phenyl)propanoate is an important chiral amino acid benzyl ester derivative, containing a methylsulfonyl functional group and a benzyl ester protecting structure. As a key organic intermediate for drug synthesis, it can be used in the synthesis of Lifitegrast, with a CAS registry number of 1194550-59-8, a molecular formula of C₁₇H₁₉NO₄S, and a molecular weight of 369.86. It is typically a white to off-white crystalline powder with good stability, suitable for drug synthesis scenarios.

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Its key physicochemical properties are as follows: it is soluble in polar organic solvents such as methanol, ethanol, dichloromethane and ethyl acetate, slightly soluble in water, and insoluble in non-polar solvents like petroleum ether and n-hexane. The melting point ranges from 128–132℃, the product purity is generally ≥98% (determined by HPLC), and the water content is ≤0.5%. The benzyl ester group in the molecule can realize selective protection and deprotection of the carboxyl group, facilitating subsequent functional group modification, while the amino group can participate in condensation, amidation and other reactions, adapting to subsequent drug synthesis processes.

In terms of safety and storage, this compound is slightly irritating to the skin, respiratory tract and eyes. Protective gloves, goggles and masks should be worn during operation to avoid direct contact and inhalation; if contact occurs accidentally, rinse the affected area with plenty of water immediately. It should be sealed in a light-proof container and stored in a cool (2–8℃), dry and well-ventilated place, away from strong oxidants, strong acids and alkalis, and avoid high temperatures and humid environments to prevent oxidation, degradation or racemization, while avoiding benzyl ester group hydrolysis, ensuring storage stability and chiral purity.

product Specification

Item

Unit

Specification

Appearance

 

a white to off-white crystalline powder

Solubility

 

soluble in polar organic solvents such as methanol, ethanol, dichloromethane and ethyl acetate, slightly soluble in water, and insoluble in non-polar solvents like petroleum ether and n-hexane.

Melting point

128–132

Identification

 

infrared spectroscopy + HPLC retention time

Other impurities

%

≤0.1 

Related Substances - Total Impurities

%

≤2.0

Main peak purity

%

≥98.0

Water content

%

≤0.5

Storage

 

seale in a light-proof container and store in a cool (2–8℃), dry and well-ventilated place.

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