Methyl 2-amino-4,6-dimethoxybenzoate

Base Information

• Chemical Name: Methyl 2-amino-4,6-dimethoxybenzoate
• CAS No.: 379228-26-9
• Molecular Formula: C10H13NO4
• Molecular Weight: 211.218
• Hs Code.: 2922509090
• DSSTox Substance ID: DTXSID50468414
• Wikidata: Q82295597
• Mol file: 379228-26-9.mol

Synonyms:methyl 2-amino-4,6-dimethoxybenzoate;379228-26-9;Benzoic acid, 2-amino-4,6-dimethoxy-, methyl ester;SCHEMBL1012543;2-AMINO-4,6-DIMETHOXY-BENZOIC ACID METHYL ESTER;DTXSID50468414;AXIFIORAYHVIGR-UHFFFAOYSA-N;methyl2-amino-4,6-dimethoxybenzoate;MFCD09031994;AKOS010054638;BS-16691;CS-0150504;D82690;EN300-6511423;A905504

Chemical Property of Methyl 2-amino-4,6-dimethoxybenzoate

Chemical Property:

• Boiling Point: 368.9±37.0 °C(Predicted)
• PKA: 1.75±0.10(Predicted)
• PSA: 70.78000
• Density: 1.189±0.06 g/cm3(Predicted)
• LogP: 1.65380
• Storage Temp.: Keep in dark place,Inert atmosphere,Room temperature
• XLogP3: 1.6
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 4
• Exact Mass: 211.08445790
• Heavy Atom Count: 15
• Complexity: 222

Purity/Quality:

97% ^*data from raw suppliers

Methyl2-Amino-4,6-dimethoxybenzoate ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COC1=CC(=C(C(=C1)OC)C(=O)OC)N
• Uses: Methyl 2-Amino-4,6-dimethoxybenzoate acts as a reagent for the preparation of C-5 substituted anilinoquinazolines as inhibitors of epidermal growth factor receptor tyrosine kinase

Technology Process of Methyl 2-amino-4,6-dimethoxybenzoate

There total 5 articles about Methyl 2-amino-4,6-dimethoxybenzoate 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: 95.0%

diazomethane (186581-53-3,908094-01-9,334-88-3) + 2-amino-4,6-dimethoxybenzoic acid (21577-57-1) → methyl 2-amino-4,6-dimethoxybenzoate (379228-26-9)

Guidance literature:

In ethanol; dichloromethane; at 0 ℃;

DOI:10.1021/jm060434q

Reference yield:

N-methyl-N-nitrosotoluene-p-sulfonamide (80-11-5) + 2-amino-4,6-dimethoxybenzoic acid (21577-57-1) → methyl 2-amino-4,6-dimethoxybenzoate (379228-26-9)

Guidance literature:

With sodium hydroxide; In ethanol; dichloromethane;

Reference yield:

2-amino-4,6-dimethoxybenzoic acid (21577-57-1) + diazomethyl-trimethyl-silane (18107-18-1) → methyl 2-amino-4,6-dimethoxybenzoate (379228-26-9)

Guidance literature:

In tetrahydrofuran; methanol; at 20 ℃;

DOI:10.1021/jm0509389

upstream raw materials:

2-amino-4,6-dimethoxybenzoic acid

diazomethyl-trimethyl-silane

diazomethane

4,6-dimethoxyindoline-2,3-dione

Downstream raw materials:

5,7-dimethoxyquinazolin-4(3H)-one

5,7-dimethoxy-3-(4-methoxyphenyl)-2,4-(1H,3H)-quinazolinedione

4-chloro-5,7-bis(methyloxy)quinazoline

(2-chloro-5-methoxy-phenyl)-(5,7-dimethoxy-quinazolin-4-yl)-amine