13-[(2-Nitrophenyl)methyl]-1,4,7,10-tetraoxa-13-azacyclopentadecane

Base Information

Chemical Name:13-[(2-Nitrophenyl)methyl]-1,4,7,10-tetraoxa-13-azacyclopentadecane
CAS No.:88548-59-8
Molecular Formula:C17H26N2O6
Molecular Weight:354.403
Hs Code.:
DSSTox Substance ID:DTXSID20557061
Wikidata:Q82438814

Synonyms:88548-59-8;DTXSID20557061;13-[(2-Nitrophenyl)methyl]-1,4,7,10-tetraoxa-13-azacyclopentadecane

Suppliers and Price of 13-[(2-Nitrophenyl)methyl]-1,4,7,10-tetraoxa-13-azacyclopentadecane

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
Packaging
price

Total 1 raw suppliers

Chemical Property of 13-[(2-Nitrophenyl)methyl]-1,4,7,10-tetraoxa-13-azacyclopentadecane

Chemical Property:

XLogP3:1.1
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:2
Exact Mass:354.17908655
Heavy Atom Count:25
Complexity:350

Purity/Quality:: 85.0-99.8% ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1COCCOCCOCCOCCN1CC2=CC=CC=C2[N+](=O)[O-]

Technology Process of 13-[(2-Nitrophenyl)methyl]-1,4,7,10-tetraoxa-13-azacyclopentadecane

There total 4 articles about 13-[(2-Nitrophenyl)methyl]-1,4,7,10-tetraoxa-13-azacyclopentadecane 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: 96.0%

: 612-23-7
2-nitrobenzyl chloride

: 66943-05-3
1,4,7,10-tetraoxa-15-azacyclopentadecane

: 88548-59-8
N-(2-nitrobenzyl)monoaza-15-crown-5

Guidance literature:: With sodium carbonate; In acetonitrile; Heating;
DOI:10.1021/jo00232a021

Reference yield: 35.0%

: 3958-60-9
2-nitrophenylmethyl bromide

: 66943-05-3
1,4,7,10-tetraoxa-15-azacyclopentadecane

: 88548-59-8
N-(2-nitrobenzyl)monoaza-15-crown-5

Guidance literature:: With sodium carbonate; In acetonitrile; for 24h; Heating;
DOI:10.1021/ja00318a014

Reference yield:

: 19249-03-7
triethylene glycol di-(p-toluenesulfonate)

: 88548-59-8
N-(2-nitrobenzyl)monoaza-15-crown-5

Guidance literature:: Multi-step reaction with 3 steps

1: 46 percent / NaH / tetrahydrofuran

2: 98 percent / H₂, trace HCl / Pd-C

3: 96 percent / Na₂CO₃ / acetonitrile / 24 h / Heating

With hydrogenchloride; hydrogen; sodium hydride; sodium carbonate; palladium on activated charcoal; In tetrahydrofuran; acetonitrile;
DOI:10.1021/ja00274a047