Methyl 3-amino-5-(2-methoxyphenyl)thiophene-2-carboxylate

Base Information

• Chemical Name: Methyl 3-amino-5-(2-methoxyphenyl)thiophene-2-carboxylate
• CAS No.: 354811-94-2
• Molecular Formula: C13H13NO3S
• Molecular Weight: 263.317
• Hs Code.: 2934999090
• DSSTox Substance ID: DTXSID20591627
• Wikidata: Q82485439
• Mol file: 354811-94-2.mol

Synonyms:354811-94-2;Methyl 3-amino-5-(2-methoxyphenyl)thiophene-2-carboxylate;Methyl 3-amino-5-(2-methoxyphenyl)-thiophene-2-carboxylate;SCHEMBL4092093;DTXSID20591627;Methyl3-amino-5-(2-methoxyphenyl)thiophene-2-carboxylate;AKOS005921003;DB-351939

Chemical Property of Methyl 3-amino-5-(2-methoxyphenyl)thiophene-2-carboxylate

Chemical Property:

• PSA: 89.79000
• LogP: 3.37370
• Storage Temp.: 2-8°C
• XLogP3: 3.3
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 4
• Exact Mass: 263.06161445
• Heavy Atom Count: 18
• Complexity: 300

Purity/Quality:

≥99% ^*data from raw suppliers

Methyl3-amino-5-(2-methoxyphenyl)-thiophene-2-carboxylate 97% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COC1=CC=CC=C1C2=CC(=C(S2)C(=O)OC)N

Technology Process of Methyl 3-amino-5-(2-methoxyphenyl)thiophene-2-carboxylate

There total 2 articles about Methyl 3-amino-5-(2-methoxyphenyl)thiophene-2-carboxylate 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: 50.0%

C10H8ClNO + Methyl thioglycolate (2365-48-2) → methyl 3-amino-5-(2-methoxyphenyl)thiophene-2-carboxylate (354811-94-2)

Guidance literature:

With sodium methylate; In methanol; for 3h; Reflux;

DOI:10.1016/j.tetlet.2019.151185

Reference yield:

2-Methoxyacetophenone (579-74-8) → methyl 3-amino-5-(2-methoxyphenyl)thiophene-2-carboxylate (354811-94-2)

Guidance literature:

Reference yield: 65.0%

phenylhydrazine (100-63-0) + methyl 3-amino-5-(2-methoxyphenyl)thiophene-2-carboxylate (354811-94-2) → 2-(2-methoxyphenyl)-4H-thieno[3,2-b]indole

Guidance literature:

methyl 3-amino-5-(2-methoxyphenyl)thiophene-2-carboxylate; With sodium hydroxide; In water; isopropyl alcohol; for 4h; Reflux;

phenylhydrazine; In acetic acid; for 1.5h; Reflux;

DOI:10.1016/j.tetlet.2019.151185

upstream raw materials:

2-Methoxyacetophenone

Methyl thioglycolate

Downstream raw materials:

3-amino-5-(2-methoxyphenyl)-2-thiophenecarboxamide

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