N-(2-((2-Hydroxyethyl)amino)-2-oxoethyl)benzamide

Base Information

• Chemical Name: N-(2-((2-Hydroxyethyl)amino)-2-oxoethyl)benzamide
• CAS No.: 72085-01-9
• Molecular Formula: C11H14 N2 O3
• Molecular Weight: 222.244
• Hs Code.: 2924299090
• DSSTox Substance ID: DTXSID30376982
• Nikkaji Number: J807.303A
• Wikidata: Q82165973
• ChEMBL ID: CHEMBL1413353
• Mol file: 72085-01-9.mol

Synonyms:72085-01-9;N-(2-((2-Hydroxyethyl)amino)-2-oxoethyl)benzamide;N-{2-[(2-hydroxyethyl)amino]-2-oxoethyl}benzenecarboxamide;N-[2-(2-hydroxyethylamino)-2-oxoethyl]benzamide;N-[2-[(2-Hydroxyethyl)amino]-2-oxoethyl]benzenecarboxamide;N-(2-(2-hydroxyethylamino)-2-oxoethyl)benzamide;N-{2-[(2-Hydroxyethyl)amino]-2-oxoethyl}benzamide;N-(2-hydroxyethyl)-2-(phenylformamido)acetamide;MLS000696241;CHEMBL1413353;DTXSID30376982;HMS2633P20;HMS3363I12;MFCD00140890;AKOS005069864;SMR000333344;CS-0355542;FT-0641391;1F-965;A837418;J-522788;Z31725269;N-[2-(2-hydroxyethylamino)-2-oxidanylidene-ethyl]benzamide;N-[2-[(2-Hydroxyethyl)amino]-2-oxoethyl] benzenecarboxamide

Chemical Property of N-(2-((2-Hydroxyethyl)amino)-2-oxoethyl)benzamide

Chemical Property:

• Vapor Pressure: 4.08E-14mmHg at 25°C
• Melting Point: 126-128°C
• Boiling Point: 576.2°C at 760 mmHg
• Flash Point: 302.3°C
• PSA: 78.43000
• Density: 1.216g/cm³
• LogP: 0.30670
• XLogP3: -0.6
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 5
• Exact Mass: 222.10044231
• Heavy Atom Count: 16
• Complexity: 237

Purity/Quality:

97% ^*data from raw suppliers

N-{2-[(2-Hydroxyethyl)amino]-2-oxoethyl}benzenecarboxamide >95% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: C1=CC=C(C=C1)C(=O)NCC(=O)NCCO

Technology Process of N-(2-((2-Hydroxyethyl)amino)-2-oxoethyl)benzamide

There total 9 articles about N-(2-((2-Hydroxyethyl)amino)-2-oxoethyl)benzamide 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: 73.0%

benzoylamino-acetic acid benzyl ester (19811-58-6) + ethanolamine (141-43-5) → N-2-(2-hydroxyethylamino)-2-oxoethylbenzamide (72085-01-9)

Guidance literature:

at 40 ℃; for 0.333333h; regioselective reaction; In incubator;

DOI:10.1016/j.tetlet.2011.03.039

Reference yield:

Hippuric Acid (495-69-2,140480-84-8,21251-67-2,91787-63-2,66407-11-2) → N-2-(2-hydroxyethylamino)-2-oxoethylbenzamide (72085-01-9)

Guidance literature:

Multi-step reaction with 2 steps

1: dmap; dicyclohexyl-carbodiimide / dichloromethane / 20 °C

2: 0.33 h / 40 °C / In incubator

With dmap; dicyclohexyl-carbodiimide; In dichloromethane;

DOI:10.1016/j.tetlet.2011.03.039

Reference yield:

ethyl hippurate (1499-53-2) + ethanolamine (141-43-5) → N-2-(2-hydroxyethylamino)-2-oxoethylbenzamide (72085-01-9)

Guidance literature:

DOI:10.1021/ja01156a013

upstream raw materials:

2-phenylazlactone

ethanolamine

methyl hippurate

ethyl hippurate

Downstream raw materials:

Chlorameisensaeure-(2-hippuroyl-amido-ethyl)-ester

Hippsaeure-(2-amino-ethyl)-ester

ethanolamine

methoxycarbonylmethylamine

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