4-Nitro-2-(phenylmethoxy)benzonitrile

Base Information

Chemical Name:4-Nitro-2-(phenylmethoxy)benzonitrile
CAS No.:380241-64-5
Molecular Formula:C14H10N2O3
Molecular Weight:254.245
Hs Code.:
DSSTox Substance ID:DTXSID901286315
Mol file:380241-64-5.mol

Synonyms:4-nitro-2-(phenylmethoxy)benzonitrile;SCHEMBL3966688;DTXSID901286315;380241-64-5

Suppliers and Price of 4-Nitro-2-(phenylmethoxy)benzonitrile

Supply Marketing:

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

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Chemical Property of 4-Nitro-2-(phenylmethoxy)benzonitrile

Chemical Property:

XLogP3:2.9
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:3
Exact Mass:254.06914219
Heavy Atom Count:19
Complexity:351

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:C1=CC=C(C=C1)COC2=C(C=CC(=C2)[N+](=O)[O-])C#N

Technology Process of 4-Nitro-2-(phenylmethoxy)benzonitrile

There total 2 articles about 4-Nitro-2-(phenylmethoxy)benzonitrile 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: 100.0%

: 39835-14-8
2-hydroxy-4-nitro-benzonitrile

: 100-39-0
benzyl bromide

: 380241-64-5
2-(benzyloxy)-4-nitrobenzonitrile

Guidance literature:: With potassium carbonate; In acetone; for 21h; Reflux;
DOI:10.1002/chem.201403645

Reference yield:

: 2620-44-2
5-nitro-1,3-benzodioxole

: 380241-64-5
2-(benzyloxy)-4-nitrobenzonitrile

Guidance literature:: Multi-step reaction with 2 steps

1: 31 percent / hexamethylphosphoric acid triamide / 0.5 h / 150 °C

2: 72 percent / K₂CO₃ / 2 h

With potassium carbonate; In N,N,N,N,N,N-hexamethylphosphoric triamide;
DOI:10.1021/jm010244+