2-Phenylpropanenitrile

Base Information

Chemical Name:2-Phenylpropanenitrile
CAS No.:1823-91-2
Deprecated CAS:42253-96-3
Molecular Formula:C9H9N
Molecular Weight:131.177
Hs Code.:29269090
European Community (EC) Number:217-354-9
NSC Number:37485,11264
DSSTox Substance ID:DTXSID10870913
Nikkaji Number:J76.365I
Wikidata:Q82855113
Mol file:1823-91-2.mol

Synonyms:2-phenylpropionitrile;2-phenylpropionitrile, (+-)-isomer

Suppliers and Price of 2-Phenylpropanenitrile

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

TRC
2-Phenylpropionitrile
2.5g
$ 50.00

TCI Chemical
2-Phenylpropionitrile >90.0%(GC)
1mL
$ 19.00

TCI Chemical
2-Phenylpropionitrile >90.0%(GC)
10mL
$ 57.00

Sigma-Aldrich
α-Methylbenzyl cyanide 96%
25g
$ 85.50

Matrix Scientific
alpha-Methylphenylacetonitrile 97%
5g
$ 20.00

Matrix Scientific
alpha-Methylphenylacetonitrile 97%
25g
$ 50.00

Crysdot
2-Phenylpropanenitrile 95+%
500g
$ 450.00

American Custom Chemicals Corporation
ALPHA-METHYLPHENYLACETONITRILE 95.00%
25G
$ 2055.90

American Custom Chemicals Corporation
ALPHA-METHYLPHENYLACETONITRILE 95.00%
2.5G
$ 836.00

Alichem
2-Phenylpropanenitrile
500g
$ 481.24

Total 55 raw suppliers

Chemical Property of 2-Phenylpropanenitrile

Chemical Property:

Appearance/Colour:clear very slightly yellow liquid
Vapor Pressure:0.0311mmHg at 25°C
Melting Point:210 °C(Solv: ethyl ether (60-29-7); chloroform (67-66-3))
Refractive Index:n20/D 1.5106(lit.)
Boiling Point:231 °C at 760 mmHg
Flash Point:93.9 °C
PSA：23.79000
Density:0.987 g/cm³
LogP:2.31368
Storage Temp.:Sealed in dry,Room Temperature
Solubility.:Chloroform
XLogP3:2.1
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:1
Exact Mass:131.073499291
Heavy Atom Count:10
Complexity:136

Purity/Quality:

99%, ^*data from raw suppliers

2-Phenylpropionitrile ^*data from reagent suppliers

Safty Information:

Pictogram(s): Xn, Xi
Hazard Codes:Xn,Xi
Statements: 20/21/22-36/37/38
Safety Statements: 26-27-37/39

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC(C#N)C1=CC=CC=C1
Uses 2-Phenylpropionitrile (cas# 1823-91-2) is a compound useful in organic synthesis.

Technology Process of 2-Phenylpropanenitrile

There total 209 articles about 2-Phenylpropanenitrile 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: 99.0%

: 164594-13-2
Phenyl[2-(trimethylsilyl)phenyl]iodonium trifluoromethanesulfonate

: 107-12-0
propiononitrile

: 1823-91-2
1-phenylethyl cyanide

Guidance literature:: propiononitrile; With n-butyllithium; In tetrahydrofuran; at -78 ℃; for 0.25h;

Phenyl[2-(trimethylsilyl)phenyl]iodonium trifluoromethanesulfonate; With tetrabutyl ammonium fluoride; In tetrahydrofuran; at 0 - 20 ℃; for 0.916667h;
DOI:10.1080/00397910600943402

Reference yield: 94.0%

: 10442-39-4
tetra-n-butylammonium cyanide

: 105966-39-0
2-(1-phenylethoxy)-tetrahydro-2H-pyran

: 1823-91-2
1-phenylethyl cyanide

Guidance literature:: With triphenylphosphine; 2,3-dicyano-5,6-dichloro-p-benzoquinone; In acetonitrile; for 6h; Heating;
DOI:10.1080/10426500490466463