Ethyl quinuclidine-2-carboxylate

Base Information

Chemical Name:Ethyl quinuclidine-2-carboxylate
CAS No.:39926-11-9
Molecular Formula:C₁₀H₁₇NO₂
Molecular Weight:183.25
Hs Code.:2933990090
European Community (EC) Number:254-706-0
DSSTox Substance ID:DTXSID40902978
Nikkaji Number:J54.284I
Mol file:39926-11-9.mol

Synonyms:Ethyl quinuclidine-2-carboxylate;39926-11-9;ETHYL 1-AZA-BICYCLO[2.2.2]OCTANE-2-CARBOXYLATE;ethylquinuclidine-2-carboxylate;ETHYL 1-AZABICYCLO[2.2.2]OCTANE-2-CARBOXYLATE;NoName_3556;SCHEMBL1616507;ethyl 2-quinuclidine carboxylate;DTXSID40902978;KCCLFMFYEDPKEL-UHFFFAOYSA-N;MFCD01684892;AKOS006277917;AS-37993;CS-0172339;NS00057363;A924942;1-Aza-bicyclo[2.2.2]octane-2-carboxylic acid ethyl ester

Suppliers and Price of Ethyl quinuclidine-2-carboxylate

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
Ethylquinuclidine-2-carboxylate
50mg
$ 175.00

TRC
Ethylquinuclidine-2-carboxylate
10mg
$ 45.00

Crysdot
Ethylquinuclidine-2-carboxylate 97%
1g
$ 567.00

Alichem
Ethylquinuclidine-2-carboxylate
1g
$ 521.16

Alichem
Ethylquinuclidine-2-carboxylate
250mg
$ 218.36

AK Scientific
Ethyl1-aza-bicyclo[2.2.2]octane-2-carboxylate
1g
$ 677.00

Total 9 raw suppliers

Chemical Property of Ethyl quinuclidine-2-carboxylate

Chemical Property:

Vapor Pressure:0.0134mmHg at 25°C
Boiling Point:258.9°Cat760mmHg
PKA:8.88±0.40(Predicted)
Flash Point:110.4°C
PSA：29.54000
Density:1.089g/cm³
LogP:0.97170
XLogP3:1.5
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:3
Exact Mass:183.125928785
Heavy Atom Count:13
Complexity:197

Purity/Quality:

97% ^*data from raw suppliers

Ethylquinuclidine-2-carboxylate ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CCOC(=O)C1CC2CCN1CC2

Technology Process of Ethyl quinuclidine-2-carboxylate

There total 10 articles about Ethyl quinuclidine-2-carboxylate 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: 78.0%

: 52601-21-5
diethyl quinuclidine-2,2-dicarboxylate

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

Guidance literature:: With hydrogenchloride; for 22h; Heating;
DOI:10.1002/hlca.19960790509

Reference yield:

: 31539-87-4
2-carboethoxy-2-dehydroquinuclidine

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

Guidance literature:: With hydrogen; palladium on activated charcoal; In ethanol; for 1h; Yield given;

Reference yield:

: 34286-16-3
2-ethoxycarbonyl-3-quinuclidinone

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

Guidance literature:: Multi-step reaction with 3 steps

1: 78 percent / sodium borohydride / ethanol / 2 h / 5 - 20 °C

2: acetic anhydride / 6 h / Heating

3: H₂ / 10percent palladium on carbon / ethanol / 1 h

With sodium tetrahydroborate; hydrogen; acetic anhydride; palladium on activated charcoal; In ethanol;