3-(3-Fluorophenyl)prop-2-enenitrile

Base Information

Chemical Name:3-(3-Fluorophenyl)prop-2-enenitrile
CAS No.:82344-56-7
Molecular Formula:C9H6FN
Molecular Weight:147.152
Hs Code.:
European Community (EC) Number:857-368-8
NSC Number:636924
Nikkaji Number:J586.294I
Mol file:82344-56-7.mol

Synonyms:3-(3-fluorophenyl)prop-2-enenitrile;82344-56-7;(E)-3-(3-fluorophenyl)prop-2-enenitrile;NSC636924;2-Propenenitrile,3-(3-fluorophenyl)-,(E)-(9CI);SCHEMBL22692;3-(3-Fluorophenyl)acrylonitrile;LZCORSHIMPJAAK-DUXPYHPUSA-N;1-Fluoro-3-(2-cyanoethenyl)benzene;Benzene, 1-fluoro-3(2-cyanoethenyl);NSC-636924;Benzene, 1-fluoro-3-(2-cyanoethenyl);(2E)-3-(3-Fluorophenyl)-2-propenenitrile #;EN300-134038;EN300-6733048;(2E)-3-(3-FLUOROPHENYL)PROP-2-ENENITRILE

Suppliers and Price of 3-(3-Fluorophenyl)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
Packaging
price

Total 4 raw suppliers

Chemical Property of 3-(3-Fluorophenyl)prop-2-enenitrile

Chemical Property:

PSA：23.79000
LogP:2.36248
XLogP3:0.8
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:1
Exact Mass:147.048427358
Heavy Atom Count:11
Complexity:189

Purity/Quality:: 99%+ ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1=CC(=CC(=C1)F)C=CC#N
Isomeric SMILES:C1=CC(=CC(=C1)F)/C=C/C#N

Technology Process of 3-(3-Fluorophenyl)prop-2-enenitrile

There total 4 articles about 3-(3-Fluorophenyl)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: 85.0%

: 456-47-3
3-fluoro-benzenemethanol

: 75-05-8,26809-02-9
acetonitrile

: 82344-56-7
(E)-3-(3-fluorophenyl)-2-propenenitrile

Guidance literature:: With iron(III) oxide; caesium carbonate; at 87 ℃; for 8h;

Reference yield:

: 372-09-8
cyanoacetic acid

: 456-48-4
3-Fluorobenzaldehyde

: 115665-80-0
(Z)-3-(3-fluorophenyl)-2-propenenitrile

: 82344-56-7
(E)-3-(3-fluorophenyl)-2-propenenitrile

Guidance literature:: With pyridine; In toluene; for 22h; Reflux;

Reference yield:

: 2537-48-6
diethyl 1-cyanomethylphosphonate

: 456-48-4
3-Fluorobenzaldehyde

: 82344-56-7
(E)-3-(3-fluorophenyl)-2-propenenitrile

Guidance literature:: diethyl 1-cyanomethylphosphonate; With sodium hydride; In tetrahydrofuran; mineral oil; at 0 ℃; for 0.5h;

3-Fluorobenzaldehyde; In tetrahydrofuran; mineral oil; at 0 - 25 ℃; for 2h;
DOI:10.1021/acs.joc.7b01303