Gallanilide

Base Information

• Chemical Name: Gallanilide
• CAS No.: 6262-27-7
• Molecular Formula: C13H11NO4
• Molecular Weight: 245.235
• European Community (EC) Number: 228-417-5
• DSSTox Substance ID: DTXSID50211669
• Nikkaji Number: J8.371B
• Wikidata: Q83086634
• Metabolomics Workbench ID: 134029
• ChEMBL ID: CHEMBL43782
• Mol file: 6262-27-7.mol

Synonyms:gallanilide;gallanilide (603);N-(beta-diethylaminoethyl)-N-(2-methylphenyl)-3',4',5'-trimethoxycarboxamide maleate

Chemical Property of Gallanilide

Chemical Property:

• Vapor Pressure: 2.04E-08mmHg at 25°C
• Boiling Point: 441.8°Cat760mmHg
• Flash Point: 221°C
• PSA: 89.79000
• Density: 1.499g/cm³
• LogP: 2.12870
• XLogP3: 1.7
• Hydrogen Bond Donor Count: 4
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 2
• Exact Mass: 245.06880783
• Heavy Atom Count: 18
• Complexity: 279

Purity/Quality:

99% ^*data from raw suppliers

3,4,5-TRIHYDROXYBENZANILIDE 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C(C=C1)NC(=O)C2=CC(=C(C(=C2)O)O)O

Technology Process of Gallanilide

There total 10 articles about Gallanilide 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: 75.0%

→ N-phenyl-3,4,5-trihydroxybenzamide (6262-27-7)

Guidance literature:

With hydrazine hydrate; In acetonitrile; at 20 ℃; for 0.5h;

Reference yield: 48.8%

3,4,5-tris(benzyloxy)-N-phenylbenzamide (872279-29-3) → N-phenyl-3,4,5-trihydroxybenzamide (6262-27-7)

Guidance literature:

With Ru(OH)2/C; hydrogen; In tetrahydrofuran; methanol;

Reference yield:

3,4,5-triacetoxy-benzoic acid anilide (128379-13-5) → N-phenyl-3,4,5-trihydroxybenzamide (6262-27-7)

Guidance literature:

With hydrazine hydrate; In dichloromethane; at 20 ℃; for 2h;

DOI:10.1016/j.bmcl.2004.01.060

upstream raw materials:

3,4,5-trihydroxybenzamide

aniline

3,4,5-triacetoxy-benzoic acid anilide

3,4,5-triacetoxybenzoyl chloride

Downstream raw materials:

3,4,5-tris(benzyloxy)-N-phenylbenzamide

3,4,5-triacetoxy-benzoic acid anilide

7-dimethylamino-3,4-dihydroxy-1-phenylcarbamoyl-phenoxazinylium; chloride

Refernces

• 1、 -. "HALOGENATED BENZOTROPOLONES AS ATG4B INHIBITORS". Page/Page column 32; 39. . Retrieved 2018/06/12.
• 2、 Abdel-Aziz, Mohamed,Matsuda, Kazuya,Otsuka, Masami,Uyeda, Masaru,Okawara, Tadashi,Suzuki, Keitarou. "Inhibitory activities against topoisomerase I & II by polyhydroxybenzoyl amide derivatives and their structure-activity relationship". . p. 1669 - 1672. Retrieved 2007/10/03.