2-Methyl-2-phenylpent-4-enenitrile

Base Information

Chemical Name:2-Methyl-2-phenylpent-4-enenitrile
CAS No.:104367-49-9
Molecular Formula:C12H13 N
Molecular Weight:171.242
Hs Code.:2926909090
DSSTox Substance ID:DTXSID90440991
Nikkaji Number:J2.024.515H
Mol file:104367-49-9.mol

Synonyms:2-methyl-2-phenylpent-4-enenitrile;104367-49-9;2-methyl-2-phenyl-pent-4-enenitrile;2-methyl-2-phenyl-4-pentenenitrile;SCHEMBL5779039;DTXSID90440991;IWIWGVIGABEPHB-UHFFFAOYSA-N;AKOS006289354

Suppliers and Price of 2-Methyl-2-phenylpent-4-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

American Custom Chemicals Corporation
2-METHYL-2-PHENYL-PENT-4-ENENITRILE 95.00%
5MG
$ 496.18

Total 1 raw suppliers

Chemical Property of 2-Methyl-2-phenylpent-4-enenitrile

Chemical Property:

Boiling Point:272.9±9.0 °C(Predicted)
PSA：23.79000
Density:0.964±0.06 g/cm3(Predicted)
LogP:3.04398
XLogP3:3.1
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:3
Exact Mass:171.104799419
Heavy Atom Count:13
Complexity:217

Purity/Quality:: 2-METHYL-2-PHENYL-PENT-4-ENENITRILE 95.00% ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

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

Technology Process of 2-Methyl-2-phenylpent-4-enenitrile

There total 12 articles about 2-Methyl-2-phenylpent-4-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: 100.0%

: 591-87-7
Allyl acetate

: 1823-91-2
1-phenylethyl cyanide

: 104367-49-9
2-methyl-2-phenylpent-4-enenitrile

Guidance literature:: With potassium hydroxide; Pd(PhCH=CH)2CO>2CO; 1,2-bis-(diphenylphosphino)ethane; In dichloromethane; Ambient temperature;

Reference yield: 99.5%

: 106-95-6
allyl bromide

: 1823-91-2
1-phenylethyl cyanide

: 104367-49-9
2-methyl-2-phenylpent-4-enenitrile

Guidance literature:: With sodium hexamethyldisilazane; In tetrahydrofuran; dimethyl sulfoxide; for 0.666667h;

Reference yield: 92.0%

: 53310-47-7
α-Ethylthio-α-phenyl-propionitril

: 106-95-6
allyl bromide

: 104367-49-9
2-methyl-2-phenylpent-4-enenitrile

Guidance literature:: With tri-n-butyltin lithium; In tetrahydrofuran; N,N,N,N,N,N-hexamethylphosphoric triamide; Ambient temperature;
DOI:10.1246/cl.1985.1149