Ethyl 2-azabicyclo[2.1.1]hexane-2-carboxylate

Base Information

Chemical Name:Ethyl 2-azabicyclo[2.1.1]hexane-2-carboxylate
CAS No.:217093-76-0
Molecular Formula:C₈H₁₃NO₂
Molecular Weight:155.197
Hs Code.:
DSSTox Substance ID:DTXSID30441326
Nikkaji Number:J1.067.570G
Wikidata:Q82258069
Mol file:217093-76-0.mol

Synonyms:217093-76-0;ethyl 2-azabicyclo[2.1.1]hexane-2-carboxylate;SCHEMBL2653632;DTXSID30441326;2-Azabicyclo[2.1.1]hexane-2-carboxylicacid,ethylester(9CI);2-AZABICYCLO[2.1.1]HEXANE-2-CARBOXYLIC ACID ETHYL ESTER;(1alpha,4alpha)-2-Azabicyclo[2.1.1]hexane-2-carboxylic acid ethyl ester

Suppliers and Price of Ethyl 2-azabicyclo[2.1.1]hexane-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

Total 4 raw suppliers

Chemical Property of Ethyl 2-azabicyclo[2.1.1]hexane-2-carboxylate

Chemical Property:

PSA：29.54000
LogP:1.17500
XLogP3:1.1
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:2
Exact Mass:155.094628657
Heavy Atom Count:11
Complexity:175

Purity/Quality:: 85.0-99.8% ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CCOC(=O)N1CC2CC1C2

Technology Process of Ethyl 2-azabicyclo[2.1.1]hexane-2-carboxylate

There total 2 articles about Ethyl 2-azabicyclo[2.1.1]hexane-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: 89.0%

: 217093-73-7
N-(ethoxycarbonyl)-5-anti-6-anti-dibromo-2-azabicyclo<2.1.1>hexane

: 217093-76-0
N-(ethoxycarbonyl)-2-azabicyclo<2.1.1>hexane

Guidance literature:: With 2,2'-azobis(isobutyronitrile); tri-n-butyl-tin hydride; In benzene; at 80 ℃; for 2h; other reagent: tris(trimethylsilyl)silane;
DOI:10.1021/jo9808472