2-Cyanoquinuclidine

Base Information

Chemical Name:2-Cyanoquinuclidine
CAS No.:90196-91-1
Molecular Formula:C8H12N2
Molecular Weight:136.197
Hs Code.:2933998090
DSSTox Substance ID:DTXSID10902748
Mol file:90196-91-1.mol

Synonyms:2-Cyanoquinuclidine;90196-91-1;1-azabicyclo[2.2.2]octane-2-carbonitrile;Quinuclidine-2-carbonitrile;1-azabicyclo[2.2.2]octane-7-carbonitrile;1-azabicyclo[2.2.2]-octane, 2-cyano;1-azabicyclo(2.2.2)-octane, 2-cyano-;NoName_3300;SCHEMBL9585978;DTXSID10902748;NZOYWQFJJHBAAF-UHFFFAOYSA-N;CS-M1534;CS-13396

Suppliers and Price of 2-Cyanoquinuclidine

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

SynQuest Laboratories
2-Cyanoquinuclidine 98.0%
100 mg
$ 1144.00

ChemScene
2-Cyanoquinuclidine
100mg
$ 518.00

Total 9 raw suppliers

Chemical Property of 2-Cyanoquinuclidine

Chemical Property:

Vapor Pressure:0.0238mmHg at 25°C
Boiling Point:248.8°Cat760mmHg
Flash Point:104.1°C
PSA：27.03000
Density:1.08g/cm³
LogP:0.93218
XLogP3:1
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:0
Exact Mass:136.100048391
Heavy Atom Count:10
Complexity:171

Purity/Quality:

97% ^*data from raw suppliers

2-Cyanoquinuclidine 98.0% ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1CN2CCC1CC2C#N

Technology Process of 2-Cyanoquinuclidine

There total 10 articles about 2-Cyanoquinuclidine 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: 40.0%

: methanesulfonic acid 1-cyano-2-piperidin-4-yl-ethyl ester

: 90196-91-1,885517-05-5
quinuclidine-2-carbonitrile

Guidance literature:: With triethylamine; In acetonitrile; Reflux;
DOI:10.1021/acs.jmedchem.9b01427

Reference yield:

: 90152-76-4
1-aza-bicyclo[2.2.2]octane-2-carboxylic acid amide

: 90196-91-1,885517-05-5
quinuclidine-2-carbonitrile

Guidance literature:

Reference yield:

: 112176-92-8,39926-11-9
(+/-)-ethyl quinuclidine-2-carboxylate

: 90196-91-1,885517-05-5
quinuclidine-2-carbonitrile

Guidance literature:: Multi-step reaction with 2 steps

1: NH₃ / methanol / 120 °C

2: triphosgene, pyridine / 0 °C

With pyridine; bis(trichloromethyl) carbonate; ammonia; In methanol;
DOI:10.1021/ja00083a014