N-[3-[bis(2-hydroxyethyl)amino]phenyl]acetamide

Base Information

• Chemical Name: N-[3-[bis(2-hydroxyethyl)amino]phenyl]acetamide
• CAS No.: 92-02-4
• Molecular Formula: C12H18N2O3
• Molecular Weight: 238.287
• European Community (EC) Number: 202-117-4
• DSSTox Substance ID: DTXSID5059038
• Nikkaji Number: J182.084B
• Mol file: 92-02-4.mol

Synonyms:92-02-4;N-(3-Bis(2-hydroxyethylamino)phenyl)acetamide;N-[3-[bis(2-hydroxyethyl)amino]phenyl]acetamide;3-(N,N-Dihydroxyethyl)amino acetanilide;EINECS 202-117-4;N-(3-(Bis(2-hydroxyethyl)amino)phenyl)acetamide;Acetamide, N-[3-[bis(2-hydroxyethyl)amino]phenyl]-;N-[3-(bis(2-hydroxyethyl)amino)phenyl]acetamide;Acetamide, N-(3-(bis(2-hydroxyethyl)amino)phenyl)-;SCHEMBL5315584;DTXSID5059038;AKOS015890438;FT-0613828;N-[3-[bis(2-hydroxyethyl)amino]phenyl]acetamid;A844127;N-[3-[bis(2-hydroxyethyl)amino]phenyl]ethanamide;W-100296;N-(3-Bis(2-hydroxyethylamino)phenyl)acetamide, 97%

Chemical Property of N-[3-[bis(2-hydroxyethyl)amino]phenyl]acetamide

Chemical Property:

• Vapor Pressure: 1.1E-11mmHg at 25°C
• Melting Point: 111-115 °C(lit.)
• Refractive Index: 1.631
• Boiling Point: 521.1 °C at 760 mmHg
• PKA: 14.29±0.10(Predicted)
• Flash Point: 269 °C
• PSA: 72.80000
• Density: 1.263 g/cm³
• LogP: 0.50900
• XLogP3: -0.1
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 6
• Exact Mass: 238.13174244
• Heavy Atom Count: 17
• Complexity: 230

Purity/Quality:

99% ^*data from raw suppliers

3-N,N-DIHYDROXYETHYL AMINO ACETANILIDE 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

• Canonical SMILES: CC(=O)NC1=CC(=CC=C1)N(CCO)CCO

Technology Process of N-[3-[bis(2-hydroxyethyl)amino]phenyl]acetamide

There total 2 articles about N-[3-[bis(2-hydroxyethyl)amino]phenyl]acetamide 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%

m-acetamide aniline (102-28-3) + 2-chloro-ethanol (107-07-3) → N,N-bis(2-hydroxyethyl)-3-acetamidoaniline (92-02-4)

Guidance literature:

With calcium carbonate; potassium iodide; In water; for 8h; Reflux;

DOI:10.1016/j.bmcl.2010.12.052

Reference yield:

→ N,N-bis(2-hydroxyethyl)-3-acetamidoaniline (92-02-4)

Guidance literature:

N-Acetyl-m-phenylendiamin-hydrochlorid, gasf. Aethylenoxyd;

Reference yield: 99.0%

2,6-dibromo-4-butylaniline (10546-66-4) + N,N-bis(2-hydroxyethyl)-3-acetamidoaniline (92-02-4) → N-(5-(bis(2-hydroxyethyl)amino)-2-((2,6-dibromo-4-butylphenyl)diazenyl)phenyl)-acetamide (1357264-57-3)

Guidance literature:

2,6-dibromo-4-butylaniline; With acetic acid; propionic acid; at 45 ℃;

With nitrosylsulfuric acid; at 0 - 5 ℃; for 1h;

N,N-bis(2-hydroxyethyl)-3-acetamidoaniline; In water; at 1 - 20 ℃;

upstream raw materials:

m-acetamide aniline

2-chloro-ethanol

Downstream raw materials:

3-(N,N-di(acetyloxyethyl)amino)-N-phenylacetamide

N-{2-(4,6-Bis-dimethylamino-[1,3,5]triazin-2-ylazo)-5-[bis-(2-hydroxy-ethyl)-amino]-phenyl}-acetamide

4'-(3-acetamidophenyl)spiro[indoline-1,1'-piperazin]-1-ium chloride

N,N-bis(2-chloroethyl)-3-acetamidoaniline

Refernces