2-((Allyloxy)methyl)-1-(2-chloroethoxy)-4-nitrobenzene

Base Information Edit

Chemical Name:2-((Allyloxy)methyl)-1-(2-chloroethoxy)-4-nitrobenzene
CAS No.:937273-31-9
Molecular Formula:C12H14ClNO4
Molecular Weight:271.7
Hs Code.:
DSSTox Substance ID:DTXSID301178768
Mol file:937273-31-9.mol

Synonyms:937273-31-9;2-((allyloxy)methyl)-1-(2-chloroethoxy)-4-nitrobenzene;2-[(Allyloxy)methyl]-1-(2-chloroethoxy)-4-nitrobenzene;1-(2-chloroethoxy)-4-nitro-2-(prop-2-enoxymethyl)benzene;2-(allyloxymethyl)-1-(2-chloroethoxy)-4-nitrobenzene;SCHEMBL1097194;DTXSID301178768;MFCD21606629;SY060732;CS-0358410;I11609;A916449;1-(2-Chloroethoxy)-4-nitro-2-[(2-propen-1-yloxy)methyl]benzene

Suppliers and Price of 2-((Allyloxy)methyl)-1-(2-chloroethoxy)-4-nitrobenzene

Supply Marketing:Edit

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

Crysdot
2-((Allyloxy)methyl)-1-(2-chloroethoxy)-4-nitrobenzene 97%
1g
$ 887.00

AK Scientific
2-((Allyloxy)methyl)-1-(2-chloroethoxy)-4-nitrobenzene
1g
$ 1261.00

Total 6 raw suppliers

Chemical Property of 2-((Allyloxy)methyl)-1-(2-chloroethoxy)-4-nitrobenzene Edit

Chemical Property:

PSA：64.28000
LogP:3.43820
XLogP3:2.6
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:7
Exact Mass:271.0611356
Heavy Atom Count:18
Complexity:269

Purity/Quality:

98.5% ^*data from raw suppliers

2-((Allyloxy)methyl)-1-(2-chloroethoxy)-4-nitrobenzene 97% ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C=CCOCC1=C(C=CC(=C1)[N+](=O)[O-])OCCCl

Technology Process of 2-((Allyloxy)methyl)-1-(2-chloroethoxy)-4-nitrobenzene

There total 5 articles about 2-((Allyloxy)methyl)-1-(2-chloroethoxy)-4-nitrobenzene 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: 89.0%

: 937273-30-8
[2-(2-chloroethoxy)-5-nitrophenyl]methanol

: 106-95-6
allyl bromide

: 937273-31-9
1-(2-chloroethoxy)-2-((allyloxy)methyl)-4-nitrobenzene

Guidance literature:: With potassium hydroxide; tetra-(n-butyl)ammonium iodide; at 20 - 40 ℃;

Reference yield:

: 110837-53-1
2-(2-chloroethoxy)-5-nitrobenzaldehyde

: 937273-31-9
1-(2-chloroethoxy)-2-((allyloxy)methyl)-4-nitrobenzene

Guidance literature:: Multi-step reaction with 2 steps

1: sodium tetrahydroborate / tetrahydrofuran / 0 - 20 °C

2: tetra(n-butyl)ammonium hydrogensulfate; potassium hydroxide / 12 h / 20 °C

With sodium tetrahydroborate; tetra(n-butyl)ammonium hydrogensulfate; potassium hydroxide; In tetrahydrofuran;
DOI:10.1021/jm200326p

Reference yield:

: 97-51-8
5-Nitrosalicylaldehyde

: 937273-31-9
1-(2-chloroethoxy)-2-((allyloxy)methyl)-4-nitrobenzene

Guidance literature:: Multi-step reaction with 3 steps

1: potassium carbonate / N,N-dimethyl-formamide / 6 h / 100 °C / Inert atmosphere

2: sodium tetrahydroborate / methanol / 1 h / 0.2 °C / Inert atmosphere

3: N-benzyl-N,N,N-triethylammonium chloride; sodium hydroxide / dichloromethane / 20 h / 20 °C

With sodium tetrahydroborate; N-benzyl-N,N,N-triethylammonium chloride; potassium carbonate; sodium hydroxide; In methanol; dichloromethane; N,N-dimethyl-formamide;
DOI:10.1021/acs.jmedchem.6b00157