Methyl 2-benzamidobenzoate

Base Information

• Chemical Name: Methyl 2-benzamidobenzoate
• CAS No.: 7510-49-8
• Molecular Formula: C15H13NO3
• Molecular Weight: 255.273
• European Community (EC) Number: 688-709-7
• NSC Number: 405693
• DSSTox Substance ID: DTXSID40324090
• Nikkaji Number: J31.004B
• Wikidata: Q82083501
• Mol file: 7510-49-8.mol

Synonyms:methyl 2-benzamidobenzoate;7510-49-8;2-BENZOYLAMINO-BENZOIC ACID METHYL ESTER;methyl 2-(benzoylamino)benzoate;NSC405693;methyl 2-[(phenylcarbonyl)amino]benzoate;methyl2-benzamidobenzoate;Maybridge1_000305;Oprea1_202471;Oprea1_233405;SCHEMBL11665959;HMS542F19;DTXSID40324090;METHYL N-BENZOYLANTHRANILATE;CCG-45973;STK010446;AKOS001627634;2-Benzoylaminobenzoic acid methyl ester;NSC 405693;NSC-405693;WS-02473;CS-0302138;EU-0017551;D85669;AG-205/03190039;SR-01000441455;SR-01000441455-1;SR-01000441455-2;Z20084240

Chemical Property of Methyl 2-benzamidobenzoate

Chemical Property:

• Vapor Pressure: 0.000247mmHg at 25°C
• Boiling Point: 324.3°Cat760mmHg
• Flash Point: 150°C
• Density: 1.237g/cm³
• XLogP3: 3.3
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 4
• Exact Mass: 255.08954328
• Heavy Atom Count: 19
• Complexity: 323

Purity/Quality:

98%,99%, ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COC(=O)C1=CC=CC=C1NC(=O)C2=CC=CC=C2

Technology Process of Methyl 2-benzamidobenzoate

There total 19 articles about Methyl 2-benzamidobenzoate 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: 98.0%

benzoyl chloride (98-88-4) + 2-carbomethoxyaniline (134-20-3) → methyl 2-(benzamido)benzoate (7510-49-8)

Guidance literature:

at 20 ℃; for 3h;

DOI:10.1021/acs.orglett.1c04028

Reference yield: 93.0%

2-bromobenzoic acid methyl ester (610-94-6) + benzamide (55-21-0,27208-38-4) → methyl 2-(benzamido)benzoate (7510-49-8)

Guidance literature:

With tris(dibenzylideneacetone)dipalladium ⁽⁰⁾; caesium carbonate; 4,5-bis(diphenylphosphino)-9,9-dimethylxanthene; In 1,4-dioxane; at 100 ℃; for 16h;

DOI:10.1021/ol005654r

Reference yield: 90.0%

methyl 2-(methyl(nitroso)amino)benzoate (68061-82-5) → benzoic acid methyl ester (93-58-3,5705-52-2,80226-58-0) + 4-nitrobenzoic acid methyl ester (619-50-1) + diphenic acid dimethyl ester (5807-64-7) + dimethyl [1,1'-biphenyl]-2,4'-dicarboxylate (55676-77-2) + dimethyl (1,1'-biphenyl)-2,3'-dicarboxylate (32947-58-3) + 2-(benzoyl-methylamino)benzoic acid methyl ester (75541-61-6) + 2-carbomethoxyaniline (134-20-3) + Methyl N-methylanthranilate (85-91-6) + methyl 2-(benzamido)benzoate (7510-49-8) + N-formylanthranilic acid methyl ester (41270-80-8)

Guidance literature:

at 220 ℃; for 0.25h; Sealed tube;

DOI:10.1039/c5ra07612a

upstream raw materials:

pyridine

benzoyl chloride

2-carbomethoxyaniline

methanol

Downstream raw materials:

2-(Benzoylamino)benzoic Acid

2-benzoylaminobenzamide

2-phenylbenzo[d][1,3]thiazine-4-thione

N,N'-di-n-propylbenzamidine

Refernces

• 1、 Arshad, Muhammad Nadeem,Ashraf, Zaman,Asim, Mulazim Hussain,Asiri, Abdullah M.,Javid, Noman,Kausar, Naghmana,Murtaza, Shahzad,Rashid, Robina. "Synthesis, characterization, biological evaluation and molecular docking studies of N-functionalized derivatives of 2-aminobenzohydrazide". . . Retrieved 2020.
• 2、 Piven, Yuri A.,Yastrebova, Margarita A.,Khamidullina, Alvina I.,Scherbakov, Alexander M.,Tatarskiy, Victor V.,Rusanova, Julia A.,Baranovsky, Alexander V.,Zinovich, Veronica G.,Khlebnicova, Tatyana S.,Lakhvich, Fedor A.. "Novel O-acylated (E)-3-aryl-6,7-dihydrobenzisoxazol-4(5H)-one oximes targeting HSP90-HER2 axis in breast cancer cells". supporting information. . Retrieved 2021/11/30.
• 3、 Altaf, Ataf Ali,Arshad, Muhammad Nadeem,Asiri, Abdullah M.,El-Bahy, Salah M.,Elnaggar, Ashraf Y.,Kausar, Naghmana,Kausar, Samia,Murtaza, Shahzad,Tatheer, Adina,Zaib Saleem, Rahman Shah. "Design, synthesis, crystal structure, in vitro cytotoxicity evaluation, density functional theory calculations and docking studies of 2-(benzamido) benzohydrazide derivatives as potent AChE and BChE inhibitors". . p. 154 - 167. Retrieved 2022/01/19.