3-Pyridineacetic acid, 1,1-dimethylethyl ester

Base Information

Chemical Name:3-Pyridineacetic acid, 1,1-dimethylethyl ester
CAS No.:69713-27-5
Molecular Formula:C11H15NO2
Molecular Weight:193.246
Hs Code.:
DSSTox Substance ID:DTXSID30468290
Nikkaji Number:J1.953.329H
Wikidata:Q82295445

Synonyms:tert-butyl 2-(pyridin-3-yl)acetate;69713-27-5;3-Pyridineacetic acid, 1,1-dimethylethyl ester;Tert-butyl 2-pyridin-3-ylacetate;SCHEMBL9784190;DTXSID30468290;XDIHUIZQEAEIIJ-UHFFFAOYSA-N;AKOS018050059;FT-0762802

Suppliers and Price of 3-Pyridineacetic acid, 1,1-dimethylethyl ester

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 3-Pyridineacetic acid, 1,1-dimethylethyl ester

Chemical Property:

XLogP3:1.3
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:4
Exact Mass:193.110278721
Heavy Atom Count:14
Complexity:196

Purity/Quality:: 99% ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC(C)(C)OC(=O)CC1=CN=CC=C1

Technology Process of 3-Pyridineacetic acid, 1,1-dimethylethyl ester

There total 1 articles about 3-Pyridineacetic acid, 1,1-dimethylethyl ester 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: 59.0%

: 1120-90-7
3-iodopyridine

: tert-butyl sodioacetate

: 1694-31-1
tert-butyl acetoacetate

: 69713-27-5
(pyridin-3-yl)acetic acid tert-butyl ester

: Di-pyridin-3-yl-acetic acid tert-butyl ester

Guidance literature:: With iron(II) sulfate; In ammonia; for 0.75h; Yields of byproduct given;

Reference yield:

: 69713-27-5
(pyridin-3-yl)acetic acid tert-butyl ester

: 501-81-5
pyridyl-3-yl-acetic acid

: 115-11-7,15220-85-6
isobutene

Guidance literature:: In gaseous matrix; at 326.9 ℃; gas-phase Hammett replacement ?⁰ substituent constant was investigated;
DOI:10.1016/S0040-4039(00)99558-3