3-Tert-butylcyclobutanone

Base Information

Chemical Name:3-Tert-butylcyclobutanone
CAS No.:20614-90-8
Molecular Formula:C8H14O
Molecular Weight:126.199
Hs Code.:2914299000
European Community (EC) Number:840-973-6
Nikkaji Number:J895.990K
Mol file:20614-90-8.mol

Synonyms:3-tert-butylcyclobutanone;20614-90-8;3-tert-butylcyclobutan-1-one;Cyclobutanone, 3-(1,1-dimethylethyl)-;3-?tert-?butylcyclobutanone;3-t-Butylcyclobutanone;SCHEMBL2691341;DUGBXGJNDWCDTG-UHFFFAOYSA-N;MFCD19441103;AKOS017514675;PB41770;AS-54193;CS-0051777;FT-0723364;EN300-180349;P17616

Suppliers and Price of 3-Tert-butylcyclobutanone

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
3-tert-butylcyclobutan-1-one
5mg
$ 65.00

Labseeker
3-TERT-BUTYLCYCLOBUTANONE 95
10g
$ 2466.00

AK Scientific
3-Tert-butylcyclobutanone
5g
$ 3956.00

AK Scientific
3-Tert-butylcyclobutanone
1g
$ 1429.00

Total 7 raw suppliers

Chemical Property of 3-Tert-butylcyclobutanone

Chemical Property:

PSA：17.07000
LogP:2.01160
XLogP3:1.7
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:1
Exact Mass:126.104465066
Heavy Atom Count:9
Complexity:122

Purity/Quality:

99%, ^*data from raw suppliers

3-tert-butylcyclobutan-1-one ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC(C)(C)C1CC(=O)C1

Technology Process of 3-Tert-butylcyclobutanone

There total 7 articles about 3-Tert-butylcyclobutanone 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: 56.0%

: 182755-64-2
3-tert-butyl-2,2-dichlorocyclobutanone

: 20614-90-8
3-(tert-butyl)cyclobutanone

Guidance literature:: With ammonium chloride; zinc; In methanol; for 5h;

Reference yield: 12.0%

: 558-37-2
tert-butylethylene

: 76-02-8
trifluoroacetyl chloride

: 20614-90-8
3-(tert-butyl)cyclobutanone

Guidance literature:: tert-butylethylene; trifluoroacetyl chloride; With zinc; trichlorophosphate; In diethyl ether; at 40 ℃; for 8h; Inert atmosphere; Schlenk technique;

With acetic acid; at 20 - 80 ℃; for 16h; Inert atmosphere; Schlenk technique;
DOI:10.1002/anie.202100642

Reference yield:

: 201230-82-2
carbon monoxide

: 558-17-8
tert-Butyl iodide

: 106-95-6
allyl bromide

: 20614-90-8
3-(tert-butyl)cyclobutanone

Guidance literature:: allyl bromide; With [(η5-pentamethylcyclopentadienyl)2TiCl]; In tetrahydrofuran; at -35 ℃; for 0.0166667h;

tert-Butyl iodide; With samarium diiodide; In tetrahydrofuran; at -35 - 20 ℃;

carbon monoxide; In pentane; at 45 ℃; for 12h; under 517.162 Torr; Further stages.;
DOI:10.1021/ja0158657