2-[2-Nitro-6-(trifluoromethyl)phenyl]acetonitrile

Base Information

Chemical Name:2-[2-Nitro-6-(trifluoromethyl)phenyl]acetonitrile
CAS No.:105003-99-4
Molecular Formula:C₉H₅F₃N₂O₂
Molecular Weight:230.146
Hs Code.:
DSSTox Substance ID:DTXSID601247477
Mol file:105003-99-4.mol

Synonyms:2-Nitro-6-(trifluoromethyl)phenylacetonitrile;105003-99-4;2-[2-nitro-6-(trifluoromethyl)phenyl]acetonitrile;DTXSID601247477;2-Nitro-6-(trifluoromethyl)benzeneacetonitrile;[2-Nitro-6-(trifluoromethyl)phenyl]acetonitrile #;Benzeneacetonitrile, 2-nitro-6-(trifluoromethyl)-

Suppliers and Price of 2-[2-Nitro-6-(trifluoromethyl)phenyl]acetonitrile

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 2 raw suppliers

Chemical Property of 2-[2-Nitro-6-(trifluoromethyl)phenyl]acetonitrile

Chemical Property:

XLogP3:2.3
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:1
Exact Mass:230.03031189
Heavy Atom Count:16
Complexity:315

Purity/Quality:: 95% ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

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

Technology Process of 2-[2-Nitro-6-(trifluoromethyl)phenyl]acetonitrile

There total 3 articles about 2-[2-Nitro-6-(trifluoromethyl)phenyl]acetonitrile 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:

: 61540-35-0
S-(Dimethylthiocarbamoyl)thioglycolonitrile

: 98-46-4
3-trifluoromethylnitrobenzene

: 13544-06-4
[2-nitro-4-(trifluoromethyl)phenyl]acetonitrile

: 105003-99-4
6-trifluoromethyl-2-nitrophenylacetonitrile

Guidance literature:: With potassium tert-butylate; In tetrahydrofuran; at -20 - -10 ℃; for 0.5h; Yield given. Yields of byproduct given;

Reference yield:

: 98-46-4
3-trifluoromethylnitrobenzene

: 3598-14-9
phenoxyacetonitrile

: 13544-06-4
[2-nitro-4-(trifluoromethyl)phenyl]acetonitrile

: 105003-99-4
6-trifluoromethyl-2-nitrophenylacetonitrile

Guidance literature:: With potassium tert-butylate; In tetrahydrofuran; at -20 - -10 ℃; for 0.00833333h; Yield given. Yields of byproduct given. Title compound not separated from byproducts;

Reference yield:

: 98-46-4
3-trifluoromethylnitrobenzene

: 107-14-2
chloroacetonitrile

: 13544-06-4
[2-nitro-4-(trifluoromethyl)phenyl]acetonitrile

: 105003-99-4
6-trifluoromethyl-2-nitrophenylacetonitrile

Guidance literature:: With potassium tert-butylate; In tetrahydrofuran; at -20 - -10 ℃; for 0.00833333h; Yield given. Yields of byproduct given;