Ethyl Amino(2-chlorophenyl)acetate

Base Information

• Chemical Name: Ethyl Amino(2-chlorophenyl)acetate
• CAS No.: 500772-75-8
• Molecular Formula: C₁₀H₁₂ClNO₂
• Molecular Weight: 213.664
• DSSTox Substance ID: DTXSID501291221
• Mol file: 500772-75-8.mol

Synonyms:Ethyl Amino(2-chlorophenyl)acetate;Ethyl 2-amino-2-(2-chlorophenyl)acetate;500772-75-8;DTXSID501291221;AKOS010013485;Ethyl alpha-amino-2-chlorobenzeneacetate;CS-0298791;FT-0742787;EN300-82035;Benzeneacetic acid, |A-amino-2-chloro-, ethyl ester

Chemical Property of Ethyl Amino(2-chlorophenyl)acetate

Chemical Property:

• XLogP3: 1.9
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 4
• Exact Mass: 213.0556563
• Heavy Atom Count: 14
• Complexity: 199

Purity/Quality:

99% ^*data from raw suppliers

Ethyl amino(2-chlorophenyl)acetate 97% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CCOC(=O)C(C1=CC=CC=C1Cl)N

Technology Process of Ethyl Amino(2-chlorophenyl)acetate

There total 1 articles about Ethyl Amino(2-chlorophenyl)acetate 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: 94.0%

2-amino-(2-chlorophenyl)ethanoic acid (86169-24-6,141196-64-7,141315-50-6,88744-36-9) → ethyl 2-amino-2-(2-chlorophenyl)acetate (500772-75-8)

Guidance literature:

With thionyl chloride; In ethanol; at 0 - 90 ℃; for 5h;

DOI:10.1002/chem.201802465

Reference yield: 46.96%

L-Tartaric acid (87-69-4,138508-61-9) + ethyl 2-amino-2-(2-chlorophenyl)acetate (500772-75-8) → C4H6O6*C10H12ClNO2

Guidance literature:

With benzaldehyde; In methanol; acetone; at 30 ℃; for 16h; Green chemistry;

Reference yield:

cinnamyl acetate (103-54-8) + ethyl 2-amino-2-(2-chlorophenyl)acetate (500772-75-8) → C19H20ClNO2 + C19H20ClNO2

Guidance literature:

With bis(η3-allyl-μ-chloropalladium(II)); 1,3-bis-(diphenylphosphino)propane; C₂₄H₂₂O₃Si; 1,8-diazabicyclo[5.4.0]undec-7-ene; zinc(II) chloride; In toluene; at 30 ℃; for 48h; Overall yield = 25 %; Overall yield = 16.3 mg; enantioselective reaction; Inert atmosphere;

DOI:10.1021/jacs.9b01910

upstream raw materials:

2-amino-(2-chlorophenyl)ethanoic acid

Downstream raw materials:

ethyl 4-benzoyl-2-(2-chlorophenyl)-5-(4-nitrophenyl)-2,5-dihydro-1H-pyrrole-2-carboxylate

ethyl 4-benzoyl-2-(2-chlorophenyl)-5-(4-nitrophenyl)-2,5-dihydro-1H-pyrrole-2-carboxylate