1-(4-(tert-Butyl)pyridin-2-yl)ethanone

Base Information

Chemical Name:1-(4-(tert-Butyl)pyridin-2-yl)ethanone
CAS No.:41225-63-2
Molecular Formula:C₁₁H₁₅NO
Molecular Weight:177.246
Hs Code.:
DSSTox Substance ID:DTXSID50566707
Wikidata:Q82452451
Mol file:41225-63-2.mol

Synonyms:41225-63-2;1-(4-(tert-Butyl)pyridin-2-yl)ethanone;1-(4-TERT-BUTYLPYRIDIN-2-YL)ETHANONE;2-acetyl-4-tert-butylpyridine;1-(4-TERT-BUTYLPYRIDIN-2-YL)ETHAN-1-ONE;SCHEMBL6170594;DTXSID50566707;MICFULKXEILLAF-UHFFFAOYSA-N;AKOS006303177;AB60310;EN300-6490189;J-400231

Suppliers and Price of 1-(4-(tert-Butyl)pyridin-2-yl)ethanone

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

Crysdot
1-(4-(tert-Butyl)pyridin-2-yl)ethanone 97%
1g
$ 447.00

Alichem
1-(4-(tert-Butyl)pyridin-2-yl)ethanone
25g
$ 4690.00

Alichem
1-(4-(tert-Butyl)pyridin-2-yl)ethanone
10g
$ 2706.80

Alichem
1-(4-(tert-Butyl)pyridin-2-yl)ethanone
5g
$ 1989.90

AK Scientific
1-(4-(Tert-Butyl)pyridin-2-yl)ethanone
1g
$ 637.00

AK Scientific
1-(4-(Tert-Butyl)pyridin-2-yl)ethanone
500mg
$ 503.00

Total 7 raw suppliers

Chemical Property of 1-(4-(tert-Butyl)pyridin-2-yl)ethanone

Chemical Property:

Boiling Point:248.1±20.0 °C(Predicted)
PKA:3.92±0.10(Predicted)
PSA：29.96000
Density:0.979±0.06 g/cm3(Predicted)
LogP:2.58170
XLogP3:2.5
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:2
Exact Mass:177.115364102
Heavy Atom Count:13
Complexity:193

Purity/Quality:

98%min ^*data from raw suppliers

1-(4-(tert-Butyl)pyridin-2-yl)ethanone 97% ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

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

Technology Process of 1-(4-(tert-Butyl)pyridin-2-yl)ethanone

There total 6 articles about 1-(4-(tert-Butyl)pyridin-2-yl)ethanone 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: 93.0%

: 917-64-6
methyl magnesium iodide

: 42205-73-2
4-tert-butyl-2-cyanopyridine

: 41225-63-2
1-(4-tert-butylpyridin-2-yl)ethanone

Guidance literature:: In diethyl ether; benzene; for 14h; Ambient temperature;

Reference yield: 60.0%

: 3978-81-2
4-tert-butylpyridine

: 127-17-3
2-oxo-propionic acid

: 41225-63-2
1-(4-tert-butylpyridin-2-yl)ethanone

Guidance literature:: With ammonium peroxydisulfate; sulfuric acid; silver nitrate; In dichloromethane; water; at 0 ℃; Reflux;
DOI:10.1039/c1cc10649j

Reference yield:

: 3978-81-2
4-tert-butylpyridine

: 41225-63-2
1-(4-tert-butylpyridin-2-yl)ethanone

Guidance literature:: Multi-step reaction with 3 steps

1.1: dihydrogen peroxide / acetic acid / 90 h / 80 °C

2.1: triethylamine / acetonitrile / 25 h / 100 °C

3.1: diethyl ether; benzene / 1.5 h / 0 °C

3.2: 26 h / 20 °C

With dihydrogen peroxide; triethylamine; In diethyl ether; acetic acid; acetonitrile; benzene;
DOI:10.1021/ja300677w