N-ACETYL-2-(3-CHLOROPHENYL)-DL-BETA-ALANINE

Base Information

• Chemical Name: N-ACETYL-2-(3-CHLOROPHENYL)-DL-BETA-ALANINE
• CAS No.: 886363-77-5
• Molecular Formula: C₁₁H₁₂ClNO₃
• Molecular Weight: 241.674
• Hs Code.: 2924299090
• Mol file: 886363-77-5.mol

Synonyms:3-Acetamido-3-(3-chlorophenyl)propanoic acid; Benzenepropanoic acid, β-(acetylamino)-3-chloro-

Chemical Property of N-ACETYL-2-(3-CHLOROPHENYL)-DL-BETA-ALANINE

Chemical Property:

• Vapor Pressure: 1.17E-09mmHg at 25°C
• Refractive Index: 1.559
• Boiling Point: 470.5 °C at 760 mmHg
• Flash Point: 238.4 °C
• PSA: 66.40000
• Density: 1.306 g/cm³
• LogP: 2.38280
• Storage Temp.: 2-8°C

Purity/Quality:

97% ^*data from raw suppliers

3-Acetamido-3-(3-chlorophenyl)propanoicacid 97% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

Technology Process of N-ACETYL-2-(3-CHLOROPHENYL)-DL-BETA-ALANINE

There total 2 articles about N-ACETYL-2-(3-CHLOROPHENYL)-DL-BETA-ALANINE 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:

3-amino-3-(3-chloro-phenyl)-propionic acid (68208-21-9) + acetic anhydride (108-24-7) → 3-acetamido-3-(3-chlorophenyl)propanoic acid (886363-77-5)

Guidance literature:

With sodium hydroxide; In water; at 40 ℃; for 8h; pH=11;

DOI:10.1002/ejoc.201201055

Reference yield:

m-Chlorobenzaldehyde (587-04-2) → 3-acetamido-3-(3-chlorophenyl)propanoic acid (886363-77-5)

Guidance literature:

Multi-step reaction with 2 steps

1: ammonium acetate / ethanol / 12 h / Reflux

2: sodium hydroxide / water / 8 h / 40 °C / pH 11

With ammonium acetate; sodium hydroxide; In ethanol; water;

DOI:10.1002/ejoc.201201055

Reference yield:

2,2,2-trifluoroethanol (75-89-8) + 3-acetamido-3-(3-chlorophenyl)propanoic acid (886363-77-5) → C13H13ClF3NO3 (1426822-61-8)

Guidance literature:

2,2,2-trifluoroethanol; 3-acetamido-3-(3-chlorophenyl)propanoic acid; With benzotriazol-1-ol; dicyclohexyl-carbodiimide; In dichloromethane; Cooling with ice;

With dmap; In dichloromethane; at 20 ℃;

DOI:10.1002/ejoc.201201055

upstream raw materials:

3-amino-3-(3-chloro-phenyl)-propionic acid

acetic anhydride

m-Chlorobenzaldehyde

Downstream raw materials:

C₁₃H₁₃ClF₃NO₃

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