Cyclohex-3-en-1-ylacetonitrile

Base Information

Chemical Name:Cyclohex-3-en-1-ylacetonitrile
CAS No.:34956-61-1
Molecular Formula:C8H11N
Molecular Weight:121.182
Hs Code.:
NSC Number:112687
DSSTox Substance ID:DTXSID00296921
Mol file:34956-61-1.mol

Synonyms:34956-61-1;cyclohex-3-en-1-ylacetonitrile;NSC112687;SCHEMBL1264951;DTXSID00296921;NSC-112687;2-(CYCLOHEX-3-EN-1-YL)ACETONITRILE;EN300-1849034

Suppliers and Price of Cyclohex-3-en-1-ylacetonitrile

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

Total 3 raw suppliers

Chemical Property of Cyclohex-3-en-1-ylacetonitrile

Chemical Property:

Vapor Pressure:0.0918mmHg at 25°C
Boiling Point:224.3°Cat760mmHg
Flash Point:95.6°C
Density:0.927g/cm³
XLogP3:1.9
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:1
Exact Mass:121.089149355
Heavy Atom Count:9
Complexity:149

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1CC(CC=C1)CC#N

Technology Process of Cyclohex-3-en-1-ylacetonitrile

There total 7 articles about Cyclohex-3-en-1-ylacetonitrile 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: 90.0%

: 773837-37-9
sodium cyanide

: 108541-48-6
[(cyclohex-3-en-1-yl)methyl]methanesulfonate

: 34956-61-1
2-(cyclohex-3-en-1-yl)acetonitrile

Guidance literature:: In dimethyl sulfoxide; at 85 - 120 ℃; for 1.5h;
DOI:10.1515/znb-2016-0129

Reference yield:

: 72581-32-9,1679-51-2
cyclohex-3-enylmethanol

: 34956-61-1
2-(cyclohex-3-en-1-yl)acetonitrile

Guidance literature:: Multi-step reaction with 2 steps

1: 84 percent / Br₂, PPh₃ / benzene / 6 h / 22 °C

2: 92 percent / aq. ethanol / 16 h / Heating

With bromine; triphenylphosphine; In ethanol; benzene;

Reference yield:

: 4771-80-6
1,2,5,6-tetrahydrobenzoic acid

: 34956-61-1
2-(cyclohex-3-en-1-yl)acetonitrile

Guidance literature:: Multi-step reaction with 3 steps

1: 100 percent / LiAlH₄ / diethyl ether / a) 22 deg C, 12 h, b) reflux, 4 h

2: 84 percent / Br₂, PPh₃ / benzene / 6 h / 22 °C

3: 92 percent / aq. ethanol / 16 h / Heating

With lithium aluminium tetrahydride; bromine; triphenylphosphine; In diethyl ether; ethanol; benzene;