1-Methyl-4-(4-nitrophenyl)-1,4-diazepane

Base Information

Chemical Name:1-Methyl-4-(4-nitrophenyl)-1,4-diazepane
CAS No.:223786-22-9
Molecular Formula:C12H17N3O2
Molecular Weight:235.286
Hs Code.:
DSSTox Substance ID:DTXSID90389538
Wikidata:Q82185413
ChEMBL ID:CHEMBL1399044
Mol file:223786-22-9.mol

Synonyms:1-methyl-4-(4-nitrophenyl)-1,4-diazepane;223786-22-9;HMS2672E15;Oprea1_729045;MLS000712731;SCHEMBL3569406;CHEMBL1399044;DTXSID90389538;XNADLAKKHYPORF-UHFFFAOYSA-N;STK675936;AKOS000600277;WAY-194754;1-(4-nitrophenyl)-4-methylhomopiperazine;SMR000282498;EU-0052283;FT-0729303;1-methyl-4-(4-nitrophenyl)-[1,4]diazepane;SR-01000526666;SR-01000526666-1

Suppliers and Price of 1-Methyl-4-(4-nitrophenyl)-1,4-diazepane

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

Manufacturers and distributors:

Manufacture/Brand
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Total 0 raw suppliers

Chemical Property of 1-Methyl-4-(4-nitrophenyl)-1,4-diazepane

Chemical Property:

XLogP3:2
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:1
Exact Mass:235.132076794
Heavy Atom Count:17
Complexity:259

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CN1CCCN(CC1)C2=CC=C(C=C2)[N+](=O)[O-]

Technology Process of 1-Methyl-4-(4-nitrophenyl)-1,4-diazepane

There total 10 articles about 1-Methyl-4-(4-nitrophenyl)-1,4-diazepane 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: 94.5%

: 4318-37-0
1-Methylhomopiperazine

: 350-46-9,178603-76-4
4-Fluoronitrobenzene

: 223786-22-9
1-methyl-4-(4-nitro-phenyl)-[1,4]-diazepane

Guidance literature:: With potassium carbonate; In water; at 100 ℃; for 5h;

Reference yield: 59.0%

: 214124-83-1
1-(4-nitrophenyl)-[1,4]diazepane

: 74-88-4
methyl iodide

: 223786-22-9
1-methyl-4-(4-nitro-phenyl)-[1,4]-diazepane

Guidance literature:: 1-(4-nitrophenyl)-[1,4]diazepane; With sodium hydride; In N,N-dimethyl-formamide; for 0.5h; cooling;

methyl iodide; In N,N-dimethyl-formamide; at 20 ℃;
DOI:10.1021/jm060262x