4-(4-Fluorophenoxy)-1-methyl-2-nitrobenzene

Base Information

Chemical Name:4-(4-Fluorophenoxy)-1-methyl-2-nitrobenzene
CAS No.:158863-10-6
Molecular Formula:C13H10FNO3
Molecular Weight:247.226
Hs Code.:
DSSTox Substance ID:DTXSID10393430
Wikidata:Q82192195
Mol file:158863-10-6.mol

Synonyms:4-(4-fluorophenoxy)-1-methyl-2-nitrobenzene;2-Nitro-4-(4-fluorophenoxy)toluene;158863-10-6;Oprea1_098956;SCHEMBL8867069;DTXSID10393430;XBOFAFRVJRTNDS-UHFFFAOYSA-N;STK376527;2-nitro-4-(4-fluorophenoxy)-toluene;AKOS005447774

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

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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price

Total 1 raw suppliers

Chemical Property of 4-(4-Fluorophenoxy)-1-methyl-2-nitrobenzene

Chemical Property:

XLogP3:4.1
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:2
Exact Mass:247.06447134
Heavy Atom Count:18
Complexity:287

Purity/Quality:: 99.90% ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC1=C(C=C(C=C1)OC2=CC=C(C=C2)F)[N+](=O)[O-]

Technology Process of 4-(4-Fluorophenoxy)-1-methyl-2-nitrobenzene

There total 2 articles about 4-(4-Fluorophenoxy)-1-methyl-2-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: 63.0%

: 371-41-5
4-Fluorophenol

: 60956-26-5
4-bromo-2-nitrotoluene

: 6-(4-fluorophenoxy)-3- {[trans-4-[(1H-2-methylimidazo[4.5-c]pyrid-1-yl)methylcyclohex-1-yl]carbonyl}indole-1 carboxylic acid dimethyl amide hydrochloride

: 158863-10-6
2-nitro-4-(4-fluorophenoxy)toluene

Guidance literature:: With pyridine; potassium carbonate; CuO;

Reference yield:

: 371-41-5
4-Fluorophenol

: 60956-26-5
4-bromo-2-nitrotoluene

: 158863-10-6
2-nitro-4-(4-fluorophenoxy)toluene

Guidance literature:: With pyridine; potassium carbonate; copper(II) oxide; Yield given. Multistep reaction; 1.) 90 deg C, 30 min, 2.) reflux, 17 h;
DOI:10.1021/jm00039a015

Reference yield:

: 158863-10-6
2-nitro-4-(4-fluorophenoxy)toluene

: (2RS,4R)-6-(4-fluorophenoxy)-3-<2-(3-pyridinyl)thiazolidin-4-oyl>indole

Guidance literature:: Multi-step reaction with 4 steps

1: DMF, pyrrolidine / 3 h / 110 °C

2: 80percent aq. AcOH, Zn / 2 h / 90 °C

3: 1.) ethylmagnesium chloride / 1.) benzene, ether, 20 min, 2.) benzene, ether, CH₂Cl₂, RT, 3 h

4: 66 percent / trifluoroacetic acid / CH₂Cl₂ / 0.67 h

With pyrrolidine; ethylmagnesium chloride; acetic acid; N,N-dimethyl-formamide; trifluoroacetic acid; zinc; In dichloromethane;
DOI:10.1021/jm00039a015