N-(Ethoxycarbonyl)anthranilic acid

Base Information

• Chemical Name: N-(Ethoxycarbonyl)anthranilic acid
• CAS No.: 41470-93-3
• Molecular Formula: C10H11 N O4
• Molecular Weight: 209.202
• Hs Code.: 2924299090
• DSSTox Substance ID: DTXSID30352064
• Nikkaji Number: J1.394.434B
• Wikidata: Q82129018
• Mol file: 41470-93-3.mol

Synonyms:N-(Ethoxycarbonyl)anthranilic acid;41470-93-3;2-(ethoxycarbonylamino)benzoic acid;2-[(ethoxycarbonyl)amino]benzoic acid;N-(ETHOXYCARBONYL)ANTHRANILIC;2-((ethoxycarbonyl)amino)benzoic acid;Oprea1_325868;Oprea1_556247;N-carbethoxy anthranilic acid;SCHEMBL10489819;DTXSID30352064;STK965922;AKOS000157657;FT-0748786;SR-01000438043;SR-01000438043-1

Chemical Property of N-(Ethoxycarbonyl)anthranilic acid

Chemical Property:

• PSA: 75.63000
• LogP: 2.02620
• XLogP3: 2.7
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 4
• Exact Mass: 209.06880783
• Heavy Atom Count: 15
• Complexity: 242

Purity/Quality:

97% ^*data from raw suppliers

2-(ETHOXYCARBONYLAMINO)BENZOIC ACID 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCOC(=O)NC1=CC=CC=C1C(=O)O

Technology Process of N-(Ethoxycarbonyl)anthranilic acid

There total 21 articles about N-(Ethoxycarbonyl)anthranilic acid 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: 88.0%

N-<(2-Phthalimidoyl-oxycarbonyl)-phenyl>-carbamidsaeureethylester (94815-09-5) → 2-((ethoxycarbonyl)amino)benzoic acid (41470-93-3)

Guidance literature:

With potassium hydroxide; In ethanol; water; benzene; Heating;

Reference yield: 85.0%

anthranilic acid (118-92-3,159201-01-1,50816-84-7,80206-34-4,104809-47-4) + diethyl dicarbonate (1609-47-8) → 2-((ethoxycarbonyl)amino)benzoic acid (41470-93-3)

Guidance literature:

In PEG-400; at 20 ℃; for 1.5h;

DOI:10.1016/j.cclet.2012.01.028

Reference yield:

isatoic anhydride (118-48-9) + ethanol (64-17-5) → 2-((ethoxycarbonyl)amino)benzoic acid (41470-93-3) + 2-ethoxycarbonylaniline (87-25-2)

Guidance literature:

at 130 - 140 ℃; im Druckrohr;

upstream raw materials:

isatoic anhydride

ethanol

ethyl 2-((ethoxycarbonyl)amino)benzoate

sodium ethanolate

Downstream raw materials:

isatoic anhydride

o-acetylamino-benzoic acid

2-methyl-4-oxo-3,1-benzoxazine

methyl 2-((ethoxycarbonyl)amino)benzoate