Ethyl alpha-[(4-chlorophenyl)amino]benzeneacetate

Base Information

• Chemical Name: Ethyl alpha-[(4-chlorophenyl)amino]benzeneacetate
• CAS No.: 5634-59-3
• Molecular Formula: C₁₆H₁₆ClNO₂
• Molecular Weight: 289.762
• DSSTox Substance ID: DTXSID701255013
• Nikkaji Number: J3.201.288D

Synonyms:Ethyl alpha-[(4-chlorophenyl)amino]benzeneacetate;DTXSID701255013;AKOS008936231;5634-59-3

Chemical Property of Ethyl alpha-[(4-chlorophenyl)amino]benzeneacetate

Chemical Property:

• XLogP3: 4.5
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 6
• Exact Mass: 289.0869564
• Heavy Atom Count: 20
• Complexity: 297

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CCOC(=O)C(C1=CC=CC=C1)NC2=CC=C(C=C2)Cl

Technology Process of Ethyl alpha-[(4-chlorophenyl)amino]benzeneacetate

There total 8 articles about Ethyl alpha-[(4-chlorophenyl)amino]benzeneacetate 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%

ethyl 2-phenyldiazoacetate (22065-57-2) + 4-chloro-aniline (106-47-8) → Estere etilico dell'acido α-(4-clorofenilamino)-fenilacetico (5634-59-3)

Guidance literature:

With C₄₃H₃₇Br₂CuN₃P₂⁽¹⁺⁾*ClO₄^(1-); In dichloromethane; at 0 - 20 ℃; for 4h; Reagent/catalyst; chemoselective reaction; Schlenk technique; Inert atmosphere;

DOI:10.1016/j.jorganchem.2016.01.016

Reference yield: 92.0%

ethyl 2-(dimethyl(oxo)- λ6-sulfaneylidene)-2-phenylacetate + 4-chloro-aniline (106-47-8) → Estere etilico dell'acido α-(4-clorofenilamino)-fenilacetico (5634-59-3)

Guidance literature:

With scandium tris(trifluoromethanesulfonate); In toluene; at 70 ℃; for 12h;

DOI:10.1002/aoc.5748

Reference yield: 68.0%

C16H14ClNO2 → Estere etilico dell'acido α-(4-clorofenilamino)-fenilacetico (5634-59-3)

Guidance literature:

With (TMS)3Al*OEt₂; In diethyl ether; pentane; at -20 - 20 ℃; for 6h;

DOI:10.3987/COM-06-S(K)23

upstream raw materials:

4-chloro-aniline

ethyl 2-phenyl-2-bromoacetate

bromo(phenyl)acetyl chloride

ethyl 2-phenyldiazoacetate

Downstream raw materials:

benzoic acid ethyl ester

(4-chloro-anilino)-phenyl-acetic acid

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