1-[(3-Nitrophenyl)sulfonyl]azepane

Base Information

Chemical Name:1-[(3-Nitrophenyl)sulfonyl]azepane
CAS No.:91619-32-8
Molecular Formula:C12H16N2O4S
Molecular Weight:284.336
Hs Code.:
DSSTox Substance ID:DTXSID501235946
ChEMBL ID:CHEMBL1491712

Synonyms:1-[(3-nitrophenyl)sulfonyl]azepane;SR-01000508671;MLS000585909;CHEMBL1491712;DTXSID501235946;HMS2572N21;STK792451;AKOS001721102;SMR000207690;EU-0017332;Hexahydro-1-[(3-nitrophenyl)sulfonyl]-1H-azepine;SR-01000508671-1;SR-01000508671-3;91619-32-8

Suppliers and Price of 1-[(3-Nitrophenyl)sulfonyl]azepane

Supply Marketing:

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

Manufacturers and distributors:

Manufacture/Brand
Chemicals and raw materials
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Total 0 raw suppliers

Chemical Property of 1-[(3-Nitrophenyl)sulfonyl]azepane

Chemical Property:

XLogP3:2.1
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:2
Exact Mass:284.08307817
Heavy Atom Count:19
Complexity:404

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:C1CCCN(CC1)S(=O)(=O)C2=CC=CC(=C2)[N+](=O)[O-]

Technology Process of 1-[(3-Nitrophenyl)sulfonyl]azepane

There total 1 articles about 1-[(3-Nitrophenyl)sulfonyl]azepane 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: 42.0%

: 111-49-9
hexamethylene imine

: 121-51-7
3-nitrobenzenesulphonyl chloride

: 91619-32-8
1-((3-nitrophenyl)sulfonyl)azepane

Guidance literature:: hexamethylene imine; With sodium hydride; In N,N-dimethyl-formamide; mineral oil; at 0 ℃; for 0.333333h; Inert atmosphere;

3-nitrobenzenesulphonyl chloride; In N,N-dimethyl-formamide; at 0 - 20 ℃; for 1.5h; Inert atmosphere;
DOI:10.1021/acs.jmedchem.9b01203

Reference yield: 82.0%

: 91619-32-8
1-((3-nitrophenyl)sulfonyl)azepane

: 91619-39-5
3-(azepan-1-ylsulfonyl)aniline

Guidance literature:: With sodium hydride; nickel dichloride; In methanol; at 0 - 20 ℃; for 0.75h; Inert atmosphere;
DOI:10.1021/acs.jmedchem.9b01203