4-Tert-butyl-2-chloropyrimidine

Base Information

Chemical Name:4-Tert-butyl-2-chloropyrimidine
CAS No.:66522-06-3
Molecular Formula:C8H11ClN2
Molecular Weight:170.642
Hs Code.:2933599590
European Community (EC) Number:817-211-6
ChEMBL ID:CHEMBL3251584

Synonyms:66522-06-3;4-tert-butyl-2-chloropyrimidine;4-(tert-Butyl)-2-chloropyrimidine;C8H11ClN2;2-Chloro-4-(1,1-dimethylethyl)pyrimidine;Pyrimidine, 2-chloro-4-(1,1-dimethylethyl)-;SCHEMBL2018538;CHEMBL3251584;LBSVYOFARGFLFV-UHFFFAOYSA-N;MFCD12402334;AKOS023555121;DS-9932;SB57566;CS-0154883;FT-0758769;EN300-222851;F16676;A867435;Z1255400259

Suppliers and Price of 4-Tert-butyl-2-chloropyrimidine

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
4-tert-butyl-2-chloropyrimidine
100mg
$ 350.00

SynQuest Laboratories
4-tert-Butyl-2-chloropyrimidine 95%
250 mg
$ 360.00

SynQuest Laboratories
4-tert-Butyl-2-chloropyrimidine 95%
1 g
$ 888.00

Crysdot
4-(tert-Butyl)-2-chloropyrimidine 98%
5g
$ 743.00

Crysdot
4-(tert-Butyl)-2-chloropyrimidine 98%
10g
$ 1238.00

Crysdot
4-(tert-Butyl)-2-chloropyrimidine 98%
1g
$ 248.00

Chemenu
4-(tert-Butyl)-2-chloropyrimidine 98%
1g
$ 234.00

Chemenu
4-(tert-Butyl)-2-chloropyrimidine 98%
10g
$ 1169.00

Chemenu
4-(tert-Butyl)-2-chloropyrimidine 98%
5g
$ 701.00

Apolloscientific
4-tert-Butyl-2-chloropyrimidine 95%
1g
$ 555.00

Total 7 raw suppliers

Chemical Property of 4-Tert-butyl-2-chloropyrimidine

Chemical Property:

Boiling Point:70 - 75 °C (0.1 mmHg)
PKA:-0.88±0.20(Predicted)
PSA：25.78000
Density:1.104±0.06 g/cm3(Predicted)
LogP:2.42750
Storage Temp.:Sealed in dry,Store in freezer, under -20°C
XLogP3:2.9
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:1
Exact Mass:170.0610761
Heavy Atom Count:11
Complexity:131

Purity/Quality:

97% ^*data from raw suppliers

4-tert-butyl-2-chloropyrimidine ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC(C)(C)C1=NC(=NC=C1)Cl

Technology Process of 4-Tert-butyl-2-chloropyrimidine

There total 7 articles about 4-Tert-butyl-2-chloropyrimidine 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: 100.0%

: 1722-12-9,1195939-87-7
2-chloropyrimidine

: 594-19-4
tert.-butyl lithium

: 66522-06-3
4-(tert-butyl)-2-chloropyrimidine

Guidance literature:: With 2,3-dicyano-5,6-dichloro-p-benzoquinone; In diethyl ether; at -30 - 0 ℃; for 1h;
DOI:10.1016/j.bmcl.2006.01.126

Reference yield: 75.0%

: 1722-12-9,1195939-87-7
2-chloropyrimidine

: 75-98-9
Trimethylacetic acid

: 66522-06-3
4-(tert-butyl)-2-chloropyrimidine

Guidance literature:: With dipotassium peroxodisulfate; silver nitrate; In dichloromethane; water; at 20 ℃; for 12h;
DOI:10.1039/c4ob02524e

Reference yield: 68.0%

: 1722-12-9,1195939-87-7
2-chloropyrimidine

: 630-19-3
pivalaldehyde

: 66522-06-3
4-(tert-butyl)-2-chloropyrimidine

Guidance literature:: With di-tert-butyl peroxide; manganese(II) acetate; In 1,2-dichloro-benzene; at 130 ℃; for 6h; Inert atmosphere; Sealed tube;
DOI:10.1021/acs.joc.9b00366