4-Phenoxybutyronitrile

Base Information

Chemical Name:4-Phenoxybutyronitrile
CAS No.:2243-43-8
Molecular Formula:C10H11 N O
Molecular Weight:161.203
Hs Code.:2926909090
European Community (EC) Number:218-812-0
NSC Number:1845
UNII:F3XR56M5Y6
DSSTox Substance ID:DTXSID80176954
Nikkaji Number:J134.790J
Wikidata:Q83047281
Mol file:2243-43-8.mol

Synonyms:4-phenoxybutanenitrile;4-Phenoxybutyronitrile;2243-43-8;F3XR56M5Y6;NSC-1845;EINECS 218-812-0;NSC1845;gamma-phenoxybutyronitrile;Butanenitrile, 4-phenoxy-;UNII-F3XR56M5Y6;SCHEMBL7501215;DTXSID80176954;HMS1767G01;CAA24343;NSC 1845;MFCD07352286;AKOS000172825;CS-0360496;Z54446528

Suppliers and Price of 4-Phenoxybutyronitrile

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
4-Phenoxybutanenitrile 97%
1g
$ 465.00

American Custom Chemicals Corporation
4-PHENOXYBUTANENITRILE 95.00%
5MG
$ 500.59

Alichem
4-Phenoxybutanenitrile
5g
$ 2030.13

AK Scientific
4-Phenoxybutanenitrile
5g
$ 4784.00

AK Scientific
4-Phenoxybutanenitrile
250mg
$ 677.00

Total 9 raw suppliers

Chemical Property of 4-Phenoxybutyronitrile

Chemical Property:

Vapor Pressure:0.0023mmHg at 25°C
Melting Point:45.5°C
Refractive Index:1.5200 (estimate)
Boiling Point:288.7°Cat760mmHg
Flash Point:121.5°C
PSA：33.02000
Density:1.031g/cm³
LogP:2.36918
XLogP3:2.3
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:4
Exact Mass:161.084063974
Heavy Atom Count:12
Complexity:153

Purity/Quality:

99% ^*data from raw suppliers

4-Phenoxybutanenitrile 97% ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1=CC=C(C=C1)OCCCC#N

Technology Process of 4-Phenoxybutyronitrile

There total 21 articles about 4-Phenoxybutyronitrile 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: 95.0%

: 143-33-9,25596-52-5
sodium cyanide

: 588-63-6
3-phenoxypropyl bromide

: 2243-43-8
4-phenoxybutyronitrile

Guidance literature:: In dimethyl sulfoxide; at 80 ℃; for 12h;
DOI:10.1080/00304940309355861

Reference yield: 88.0%

: 1200-03-9
4-bromophenyl butyl ether

: 2243-43-8
4-phenoxybutyronitrile

Guidance literature:: With sodium azide; palladium diacetate; XPhos; In acetone; at 80 ℃; for 8h; Inert atmosphere;
DOI:10.1039/c5cc03429a

Reference yield: 84.0%

: 501941-41-9
4-(4-chlorophenoxy)butyronitrile

: 2243-43-8
4-phenoxybutyronitrile

Guidance literature:: 4-(4-chlorophenoxy)butyronitrile; With palladium dichloride; In water; at 50 ℃; for 0.0333333h;

With 1,1,3,3-Tetramethyldisiloxane; for 0.966667h;
DOI:10.1021/ol5037369