501015-22-1

Basic information

• Product Name: (R)-BOC-4-CYANO-BETA-PHE-OH
• Synonyms: (r)-boc-4-cyano-β-phe-oh;Boc-D-b-Phe(4-CN)-OH;(R)-3-(Boc-amino)-3-(4-cyanophenyl)propionic acid, Boc-4-cyano-L-β-phenylalanine;(R)-3-((tert-Butoxycarbonyl)amino)-3-(4-cyanophenyl)propanoic acid;(Tert-Butoxy)Carbonyl (R)-3-Amino-3-(4-cyano-phenyl)propionic acid
• CAS NO: 501015-22-1
• Molecular Formula: C15H18N2O4
• Molecular Weight: 290.317
• Mol File: 501015-22-1.mol

Chemical Properties

• Melting Point: 120-123 °C(Solv: isopropyl ether (108-20-3))
• Boiling Point: 491.5±45.0 °C(Predicted)
• Appearance: /
• Density: 1.22±0.1 g/cm3(Predicted)
• Storage Temp.: 2-8°C
• PKA: 4.17±0.10(Predicted)
• CAS DataBase Reference: (R)-BOC-4-CYANO-BETA-PHE-OH(CAS DataBase Reference)
• NIST Chemistry Reference: (R)-BOC-4-CYANO-BETA-PHE-OH(501015-22-1)
• EPA Substance Registry System: (R)-BOC-4-CYANO-BETA-PHE-OH(501015-22-1)

Safety Data

• WGK Germany: 3
• Hazardous Substances Data: 501015-22-1(Hazardous Substances Data)

Usage

Uses

Used in Chemical Synthesis:
(R)-BOC-4-CYANO-BETA-PHE-OH is used as a synthetic intermediate for the preparation of various complex organic molecules. Its unique structure allows for the creation of a wide range of chemical entities, making it a versatile component in the field of organic chemistry.
Used in Pharmaceutical Development:
In the pharmaceutical industry, (R)-BOC-4-CYANO-BETA-PHE-OH is used as a key building block in the development of new drugs. Its presence in the molecular structure can influence the pharmacological properties, such as potency, selectivity, and bioavailability, of the final drug product.
Used in Biochemical Research:
(R)-BOC-4-CYANO-BETA-PHE-OH is employed as a research tool in biochemistry to study the interactions and mechanisms of various biological processes. Its incorporation into peptides and proteins can help researchers understand the role of specific amino acid derivatives in biological systems.
Used in Material Science:
(R)-BOC-4-CYANO-BETA-PHE-OH is used as a component in the synthesis of advanced materials, such as polymers and composites, where its unique chemical properties can contribute to the development of materials with specific characteristics, like improved strength, flexibility, or chemical resistance.

Upstream product

• 288848-50-0 ethyl (+/-)-3-amino-3-(4-cyanophenyl)propanoate 
• 80971-95-5 (+/-)-3-amino-3-(4-cyanophenyl)propanoic acid 
• 24424-99-5 di-tert-butyl dicarbonate 
• 738606-24-1 (R)-3-amino-3-(4-cyanophenyl)propanoic acid 
• 738606-23-0 ethyl (S)-3-butanoylamino-3-(4-cyanophenyl)propanoate 

Downstream Products

• 1050618-77-3 (6S)-6-(4-cyanophenyl)-4-methyl-2-oxo-N-propan-2-yl-3-[3-(trifluoromethyl)-phenyl]-5,6-dihydropyridine-1-carboxamide 
• 1050618-82-0 (3S)-3-(4-cyanophenyl)-N-methoxy-N-methyl-3-({[3-(trifluoromethyl)phenyl]acetyl}amino)propanamide 
• 1050618-71-7 4-{(2S)-1,4-dimethyl-6-oxo-5-[3-(trifluoromethyl)phenyl]-1,2,3,6-tetrahydropyridin-2-yl}benzonitrile 
• 1050618-84-2 N-[(1S)-1-(4-cyanophenyl)-3-oxobutyl]-2-[3-(trifluoromethyl)phenyl]acetamide 
• 1050618-74-0 4-{(2S)-4-methyl-6-oxo-5-[3-(trifluoromethyl)phenyl]-1,2,3,6-tetrahydropyridin-2-yl}benzonitrile 
• 1050618-86-4 C₁₂H₁₅N₃O₂ 

Relevant articles and documents

Synthesis of the enantiomers and N-protected derivatives of 3-amino-3-(4-cyanophenyl)propanoic acid

Racemic ethyl 3-amino-3-(4-cyanophenyl)propanoate was synthesized and the enantiomers separated through enantioselective N-acylation by Candida antarctica lipase A (CAL-A) in neat butyl butanoate. The free amino acid enantiomers were transformed to the Boc and Fmoc-protected derivatives.