1,3,5-Trimorpholinobenzene

Base Information

• Chemical Name: 1,3,5-Trimorpholinobenzene
• CAS No.: 16857-97-9
• Molecular Formula: C18H27N3O3
• Molecular Weight: 333.431
• DSSTox Substance ID: DTXSID30527311
• Nikkaji Number: J379.555A
• Wikidata: Q82396494
• Mol file: 16857-97-9.mol

Synonyms:1,3,5-Trimorpholinobenzene;16857-97-9;DTXSID30527311;4,4',4''-(Benzene-1,3,5-triyl)tris(morpholine)

Chemical Property of 1,3,5-Trimorpholinobenzene

Chemical Property:

• XLogP3: 1.2
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 3
• Exact Mass: 333.20524173
• Heavy Atom Count: 24
• Complexity: 311

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1COCCN1C2=CC(=CC(=C2)N3CCOCC3)N4CCOCC4

Technology Process of 1,3,5-Trimorpholinobenzene

There total 9 articles about 1,3,5-Trimorpholinobenzene 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%

morpholine (110-91-8,99108-56-2) + 1,3,5-trisbromobenzene (626-39-1) → 1,3,5-trimorpholinobenzene (16857-97-9)

Guidance literature:

With sodium t-butanolate; tris(dibenzylideneacetone)dipalladium ⁽⁰⁾; 2,2'-bis-(diphenylphosphino)-1,1'-binaphthyl; In toluene; at 100 ℃; for 24h;

DOI:10.1055/s-1998-1692

Reference yield: 52.0%

morpholine (110-91-8,99108-56-2) + 1,3,5-trichlorobenzene (108-70-3,63697-19-8) → 1,3,5-trimorpholinobenzene (16857-97-9) + 4,4'-(5-chloro-m-phenylene)-bis-morpholine (55086-81-2) + 4-(3,5-dichlorophenyl)morpholine (379266-16-7)

Guidance literature:

With styrene; tert-Amyl alcohol; sodium hydride; [2,2]bipyridinyl; nickel diacetate; In tetrahydrofuran; for 0.5h; Heating;

DOI:10.1016/S0040-4020(01)00730-X

Reference yield: 50.0%

morpholine (110-91-8,99108-56-2) + 1,3,5-trisbromobenzene (626-39-1) → 1,3,5-trimorpholinobenzene (16857-97-9) + 4-(3-morpholinophenyl)morpholine (51100-94-8)

Guidance literature:

With sodium t-butanolate; tris-(o-tolyl)phosphine; bis(dibenzylideneacetone)-palladium⁽⁰⁾; In toluene; at 100 ℃; for 24h;

DOI:10.1055/s-1998-1692

upstream raw materials:

2,4,6-Trimorpholinoiodobenzene

morpholine

1,3,5-trisbromobenzene

hexabromobenzene

Downstream raw materials:

4,4'-dinitrobiphenyl

2,2',4,4',6,6'-hexamorpholin-1-yl-1,1'-biphenyl

4,4′,4″-(2-nitrosobenzene-1,3,5-triyl)trimorpholine