1-Azabicyclo[2.2.2]oct-2-ene-3-carboxylic acid

Base Information

Chemical Name:1-Azabicyclo[2.2.2]oct-2-ene-3-carboxylic acid
CAS No.:98593-29-4
Molecular Formula:C₈H₁₁NO₂
Molecular Weight:153.181
Hs Code.:2933990090
DSSTox Substance ID:DTXSID60698063
Wikidata:Q82628135
Mol file:98593-29-4.mol

Synonyms:1-AZABICYCLO[2.2.2]OCT-2-ENE-3-CARBOXYLIC ACID;98593-29-4;DTXSID60698063;2,3-dehydroquinuclidine-3-carboxylic acid

Suppliers and Price of 1-Azabicyclo[2.2.2]oct-2-ene-3-carboxylic acid

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 1-Azabicyclo[2.2.2]oct-2-ene-3-carboxylic acid

Chemical Property:

PSA：40.54000
LogP:0.61840
XLogP3:0.5
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:1
Exact Mass:153.078978594
Heavy Atom Count:11
Complexity:214

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1CN2CCC1C(=C2)C(=O)O

Technology Process of 1-Azabicyclo[2.2.2]oct-2-ene-3-carboxylic acid

There total 2 articles about 1-Azabicyclo[2.2.2]oct-2-ene-3-carboxylic acid 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:

: 31539-88-5
methyl 1-azabicyclo(2,2,2)oct-2-ene-3-carboxylate

: 98593-29-4
1-aza-bicyclo[2.2.2]oct-2-ene-3-carboxylic acid

Guidance literature:: With hydrogenchloride;
DOI:10.1002/hlca.19540370610

Reference yield:

: 57598-88-6
3-hydroxy-3-methoxycarbonyl-1-azabicyclo[2.2.2]octane

: 98593-29-4
1-aza-bicyclo[2.2.2]oct-2-ene-3-carboxylic acid

Guidance literature:: Multi-step reaction with 2 steps

1: SOCl₂

2: aqueous HCl

With hydrogenchloride; thionyl chloride;
DOI:10.1002/hlca.19540370610