1-(4-Fluorophenyl)cyclopentanecarbonitrile

Base Information

Chemical Name:1-(4-Fluorophenyl)cyclopentanecarbonitrile
CAS No.:83706-50-7
Molecular Formula:C12H12FN
Molecular Weight:189.232
Hs Code.:29269095
European Community (EC) Number:280-526-7
DSSTox Substance ID:DTXSID90232570
Nikkaji Number:J326.840C
Wikidata:Q72475782
Mol file:83706-50-7.mol

Synonyms:1-(4-Fluorophenyl)cyclopentanecarbonitrile;83706-50-7;C12H12FN;1-(4-fluorophenyl)cyclopentane-1-carbonitrile;EINECS 280-526-7;SCHEMBL1019298;DTXSID90232570;C12-H12-F-N;AKOS009157344;FT-0641915;A864234

Suppliers and Price of 1-(4-Fluorophenyl)cyclopentanecarbonitrile

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

Crysdot
1-(4-Fluorophenyl)cyclopentanecarbonitrile 95+%
25g
$ 582.00

Chemenu
1-(4-Fluorophenyl)cyclopentanecarbonitrile 95%
25g
$ 550.00

American Custom Chemicals Corporation
1-(4-FLUOROPHENYL)CYCLOPENTANECARBONITRILE 95.00%
5G
$ 177.45

AHH
1-(4-Fluorophenyl)cyclopentanecarbonitrile 98%
50g
$ 345.00

Total 15 raw suppliers

Chemical Property of 1-(4-Fluorophenyl)cyclopentanecarbonitrile

Chemical Property:

Vapor Pressure:0.000929mmHg at 25°C
Refractive Index:1.514-1.516
Boiling Point:303.5 °C at 760 mmHg
Flash Point:129.5 °C
PSA：23.79000
Density:1.12 g/cm³
LogP:3.16108
Storage Temp.:2-8°C
XLogP3:3.1
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:1
Exact Mass:189.095377549
Heavy Atom Count:14
Complexity:238

Purity/Quality:

97% ^*data from raw suppliers

1-(4-Fluorophenyl)cyclopentanecarbonitrile 95+% ^*data from reagent suppliers

Safty Information:

Pictogram(s): Xn
Hazard Codes:Xn
Statements: 36/37/38-20/21/22
Safety Statements: 36/37/39-26

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1CCC(C1)(C#N)C2=CC=C(C=C2)F

Technology Process of 1-(4-Fluorophenyl)cyclopentanecarbonitrile

There total 1 articles about 1-(4-Fluorophenyl)cyclopentanecarbonitrile 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: 94.1%

: 110-52-1
1,4-dibromo-butane

: 459-22-3
4-fluorophenylacetonitrile

: 83706-50-7
1-(4-fluorophenyl)cyclopentane-1-carbonitrile

Guidance literature:: 4-fluorophenylacetonitrile; With sodium hydride; In N,N-dimethyl-formamide; for 0.5h; Cooling with ice;

1,4-dibromo-butane; In N,N-dimethyl-formamide; at 20 ℃; for 4h;

Reference yield: 93.0%

: 83706-50-7
1-(4-fluorophenyl)cyclopentane-1-carbonitrile

: 214262-99-4
1-(4-fluorophenyl)-1-cyclopentanecarboxylic acid

Guidance literature:: With sulfuric acid; water; at 150 ℃; for 5h;
DOI:10.1248/cpb.59.1376

Reference yield: 56.3%

: 83706-50-7
1-(4-fluorophenyl)cyclopentane-1-carbonitrile

: 1-(4-fluorophenyl)-3-oxocyclopentane-1-carbonitrile

Guidance literature:: With (R,R)-Mn(CF₃-PDP)(MeCN)2(SbF₆)2; dihydrogen peroxide; chloroacetic acid; In water; acetonitrile; at 0 ℃; for 3h; chemoselective reaction;
DOI:10.1038/s41557-018-0175-8