3-[4-Chloro-3-(trifluoromethyl)phenyl]prop-2-enenitrile

Base Information

Chemical Name:3-[4-Chloro-3-(trifluoromethyl)phenyl]prop-2-enenitrile
CAS No.:132604-91-2
Molecular Formula:C10H5ClF3N
Molecular Weight:231.605
Hs Code.:
DSSTox Substance ID:DTXSID50709536

Synonyms:132604-91-2;4-chloro-3-trifluoromethyl-cinnamonitrile;4-chloro-3-trifluoromethylcinnamonitrile;3-[4-Chloro-3-(trifluoromethyl)phenyl]prop-2-enenitrile;2-Propenenitrile, 3-[4-chloro-3-(trifluoromethyl)phenyl]-, (Z)-;DTXSID50709536

Suppliers and Price of 3-[4-Chloro-3-(trifluoromethyl)phenyl]prop-2-enenitrile

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 3-[4-Chloro-3-(trifluoromethyl)phenyl]prop-2-enenitrile

Chemical Property:

XLogP3:3.6
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:1
Exact Mass:231.0062613
Heavy Atom Count:15
Complexity:289

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

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:C1=CC(=C(C=C1C=CC#N)C(F)(F)F)Cl

Technology Process of 3-[4-Chloro-3-(trifluoromethyl)phenyl]prop-2-enenitrile

There total 1 articles about 3-[4-Chloro-3-(trifluoromethyl)phenyl]prop-2-enenitrile 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: 52.0%

: 2537-48-6
diethyl 1-cyanomethylphosphonate

: 34328-46-6
4-chloro-3-(trifluoromethyl)benzaldehyde

: 132604-91-2
4-chloro-3-trifluoromethylcinnamonitrile

: 132605-01-7
4-chloro-3-trifluoromethyl-cinnamonitrile

Guidance literature:: With potassium carbonate; In water; for 0.5h; Yield given. Title compound not separated from byproducts; Ambient temperature;
DOI:10.1016/0223-5234(90)90129-Q

Reference yield:

: 132604-91-2,132605-01-7
4-chloro-3-trifluoromethylcinnamonitrile

: 101-97-3
Ethyl 2-phenylethanoate

: 107235-07-4,107235-16-5
erythro-3-(4-chloro-3-trifluoromethylphenyl)-4-cyano-2-phenylbutanoate d'ethyle

: 107235-07-4,107235-16-5
threo-3-(4-chloro-3-trifluoromethylphenyl)-4-cyano-2-phenylbutanoate d'ethyle

Guidance literature:: With sodium amide; In tetrahydrofuran; diethyl ether; at -5 ℃; for 1.5h; Yield given. Yields of byproduct given. Title compound not separated from byproducts;
DOI:10.1016/0223-5234(90)90129-Q