2-Methylbutan-2-yl pyrimidine-5-carboxylate

Base Information

Chemical Name:2-Methylbutan-2-yl pyrimidine-5-carboxylate
CAS No.:887408-29-9
Molecular Formula:C₁₀H₁₄N₂O₂
Molecular Weight:194.233
Hs Code.:2933599090
DSSTox Substance ID:DTXSID10695466
Wikidata:Q82624659
Mol file:887408-29-9.mol

Synonyms:DTXSID10695466;2-methylbutan-2-yl pyrimidine-5-carboxylate

Suppliers and Price of 2-Methylbutan-2-yl pyrimidine-5-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

American Custom Chemicals Corporation
ETHYL-4-ISOPROPYL PYRIMIDINE-5-CARBOXYLATE 95.00%
5MG
$ 502.67

Total 3 raw suppliers

Chemical Property of 2-Methylbutan-2-yl pyrimidine-5-carboxylate

Chemical Property:

PSA：52.08000
LogP:1.82200
XLogP3:1.6
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:4
Exact Mass:194.105527694
Heavy Atom Count:14
Complexity:198

Purity/Quality:

99% ^*data from raw suppliers

ETHYL-4-ISOPROPYL PYRIMIDINE-5-CARBOXYLATE 95.00% ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CCC(C)(C)OC(=O)C1=CN=CN=C1

Technology Process of 2-Methylbutan-2-yl pyrimidine-5-carboxylate

There total 1 articles about 2-Methylbutan-2-yl pyrimidine-5-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: 22.0%

: bis-(((isopropyl)sulfinyl)oxy)zinc

: 40929-50-8
ethyl pyrimidine-5-carboxylate

: 887408-29-9
4-isopropylpyrimidine-5-carboxylic acid ethyl ester

: 954226-53-0
ethyl 2-isopropylpyrimidine-5-carboxylate

Guidance literature:: With tert.-butylhydroperoxide; zinc sulfinate; bis(((trifluoromethyl)sulfinyl)oxy)zinc; In water; dimethyl sulfoxide; at 20 - 50 ℃; for 12h; Overall yield = 42 %; regioselective reaction;
DOI:10.1021/ja406223k