Methyl 4-amino-3-ethoxybenzoate

Base Information

• Chemical Name: Methyl 4-amino-3-ethoxybenzoate
• CAS No.: 912839-50-0
• Molecular Formula: C₁₀H₁₃NO₃
• Molecular Weight: 195.218
• European Community (EC) Number: 815-642-4

Synonyms:methyl 4-amino-3-ethoxybenzoate;912839-50-0;4-amino-3-ethoxy-benzoic acid methyl ester;SCHEMBL223446;XMVGWAGVHNFMBT-UHFFFAOYSA-N;EN300-384730;A1-17026

Chemical Property of Methyl 4-amino-3-ethoxybenzoate

Chemical Property:

• XLogP3: 1.4
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 4
• Exact Mass: 195.08954328
• Heavy Atom Count: 14
• Complexity: 196

Purity/Quality:

99% ，98% ^*data from raw suppliers

Methyl4-amino-3-ethoxybenzoatehydrochloride ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CCOC1=C(C=CC(=C1)C(=O)OC)N

Technology Process of Methyl 4-amino-3-ethoxybenzoate

There total 4 articles about Methyl 4-amino-3-ethoxybenzoate 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: 93.2%

methyl 3-ethoxy-4-nitrobenzoate (594844-39-0) → methyl 4-amino-3-ethoxybenzoate (912839-50-0)

Guidance literature:

With 5%-palladium/activated carbon; In methanol; at 20 ℃; for 16h;

Reference yield: 72.0%

ethyl iodide (75-03-6) + 3-hydroxy-4-aminobenzoic acid methyl ester (63435-16-5) → methyl 4-amino-3-ethoxybenzoate (912839-50-0)

Guidance literature:

With potassium carbonate; In N,N-dimethyl-formamide; at 20 ℃; for 16h;

Reference yield: 66.7%

→ methyl 4-amino-3-ethoxybenzoate (912839-50-0)

Guidance literature:

With caesium carbonate; In acetone; for 6h; Reflux;

With ammonium hydroxide; In acetone; for 0.5h; Reflux;

upstream raw materials:

methyl 3-ethoxy-4-nitrobenzoate

methyl 3-hydroxy-4-nitrobenzoate

ethyl iodide

3-hydroxy-4-aminobenzoic acid methyl ester

Downstream raw materials:

4-amino-3-ethoxybenzoic acid hydrochloride

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