2-(4-Fluorophenyl)-3-phenylacrylonitrile

Base Information

Chemical Name:2-(4-Fluorophenyl)-3-phenylacrylonitrile
CAS No.:2558-28-3
Molecular Formula:C15H10 F N
Molecular Weight:223.25
Hs Code.:
NSC Number:405092
Mol file:2558-28-3.mol

Synonyms:2558-28-3;54648-47-4;2-(4-Fluorophenyl)-3-phenylacrylonitrile;(Z)-2-(4-Fluorophenyl)-3-phenylacrylonitrile;(2Z)-2-(4-Fluorophenyl)-3-phenylacrylonitrile;(Z)-2-(4-fluorophenyl)-3-phenylprop-2-enenitrile;NSC405092;2-(4-fluorophenyl)-3-phenylprop-2-enenitrile;NSC 405092;MFCD08059541;AKOS000352551;NSC-405092;E- alpha -(4-Fluorophenyl)cinnamonitrile;E-alpha-(4-Fluorophenyl)cinnamonitrile, 97%;(Z)-2-(4-fluorophenyl)-3-phenyl-prop-2-enenitrile

Suppliers and Price of 2-(4-Fluorophenyl)-3-phenylacrylonitrile

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

American Custom Chemicals Corporation
E-ALPHA-(4-FLUOROPHENYL)CINNAMONITRILE 95.00%
1G
$ 653.18

Total 9 raw suppliers

Chemical Property of 2-(4-Fluorophenyl)-3-phenylacrylonitrile

Chemical Property:

Vapor Pressure:0.00014mmHg at 25°C
Melting Point:101-105 °C(lit.)
Boiling Point:333.1°Cat760mmHg
Flash Point:144.1°C
PSA：23.79000
Density:1.174g/cm³
LogP:3.88988
XLogP3:3.8
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:2
Exact Mass:223.079727485
Heavy Atom Count:17
Complexity:311

Purity/Quality:

99% ^*data from raw suppliers

E-ALPHA-(4-FLUOROPHENYL)CINNAMONITRILE 95.00% ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

Canonical SMILES:C1=CC=C(C=C1)C=C(C#N)C2=CC=C(C=C2)F
Isomeric SMILES:C1=CC=C(C=C1)/C=C(\C#N)/C2=CC=C(C=C2)F

Technology Process of 2-(4-Fluorophenyl)-3-phenylacrylonitrile

There total 6 articles about 2-(4-Fluorophenyl)-3-phenylacrylonitrile 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: 87.0%

: 459-22-3
4-fluorophenylacetonitrile

: 100-51-6,185532-71-2
benzyl alcohol

: 2558-28-3
α-<4-Fluor-phenyl>-zimtsaeure-nitril

Guidance literature:: With C₃₀H₄₃ClCoN₂P₃⁽¹⁺⁾*Cl^(1-); sodium t-butanolate; In toluene; at 140 ℃; for 6h; Inert atmosphere; Sealed tube;
DOI:10.1021/acs.orglett.1c01553

Reference yield:

: 459-22-3
4-fluorophenylacetonitrile

: 100-52-7
benzaldehyde

: 2558-28-3
α-<4-Fluor-phenyl>-zimtsaeure-nitril

Guidance literature:: With sodium ethanolate; In ethanol;

Reference yield:

: 352-32-9
p-fluorotoluene

: 2558-28-3
α-<4-Fluor-phenyl>-zimtsaeure-nitril

Guidance literature:: Multi-step reaction with 3 steps

1: Cl₂ / Irradiation

3: NaOEt / ethanol

With sodium ethanolate; chlorine; In ethanol;