AC-DL-PHE(3-CN)-OH

Base Information

• Chemical Name: AC-DL-PHE(3-CN)-OH
• CAS No.: 367272-51-3
• Molecular Formula: C12H12N2O3
• Molecular Weight: 232.24
• Mol file: 367272-51-3.mol

Synonyms:AC-3-CYANO-DL-PHENYLALANINE;AC-DL-PHE(3-CN)-OH;ACETYL-3-CYANO-DL-PHENYLALANINE;AC-M-CYANO-DL-PHE-OH;N-Acetyl-3-cyanophenylalanine

Chemical Property of AC-DL-PHE(3-CN)-OH

Chemical Property:

• PSA: 90.19000
• LogP: 1.08098

Purity/Quality:

97% ^*data from raw suppliers

Ac-dl-phe(3-cn)-oh ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

Technology Process of AC-DL-PHE(3-CN)-OH

There total 1 articles about AC-DL-PHE(3-CN)-OH which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield: 73.0%

m-(bromomethyl)benzonitrile (28188-41-2) + 2-acetylaminomalonic acid diethyl ester (1068-90-2) → N-acetyl-3-cyano-(D/L)-phenylalanine (367272-51-3)

Guidance literature:

m-(bromomethyl)benzonitrile; 2-acetylaminomalonic acid diethyl ester; With potassium iodide; In 1,4-dioxane; at 98 ℃; for 5h;

With sodium methylate; In 1,4-dioxane; ethanol; at 98 ℃; for 3h;

With hydrogenchloride; sodium hydroxide; water; more than 3 stages;

Reference yield: 33.0%

N-acetyl-3-cyano-(D/L)-phenylalanine (367272-51-3) → 3-cyano-(D,L)-phenylalanine (57213-48-6)

Guidance literature:

With hydrogenchloride; sodium hydroxide; acylase I from Aspergillus melleus; In water; at 37 ℃; for 60h; pH=7.2; Enzymatic reaction;

Reference yield:

N-acetyl-3-cyano-(D/L)-phenylalanine (367272-51-3) → C12H12N2O3 (367453-00-7) + 3-cyano-(D,L)-phenylalanine (57213-48-6)

Guidance literature:

With hydrogenchloride; sodium hydroxide; Acylase I; In water; at 37 ℃; for 72h; pH=~ 7.2 - 12.8; Enzymatic reaction; Resolution of racemate;

upstream raw materials:

m-(bromomethyl)benzonitrile

2-acetylaminomalonic acid diethyl ester

Downstream raw materials:

3-cyano-(D,L)-phenylalanine

C₁₂H₁₂N₂O₃

N-TIPPS-3-cyano-(L)-phenylalanine 4-ethoxycarbonylpiperazide