1-(2-Chlorophenyl)-2,2-dimethylpropan-1-one

Base Information

Chemical Name:1-(2-Chlorophenyl)-2,2-dimethylpropan-1-one
CAS No.:61593-17-7
Molecular Formula:C11H13ClO
Molecular Weight:196.677
Hs Code.:2914700090
European Community (EC) Number:846-814-7
DSSTox Substance ID:DTXSID50478816
Nikkaji Number:J2.124.664F
Wikidata:Q82312444
Mol file:61593-17-7.mol

Synonyms:61593-17-7;2'-CHLORO-2,2-DIMETHYLPROPIOPHENONE;1-(2-Chlorophenyl)-2,2-dimethylpropan-1-one;MFCD07699557;1-(2-chloro-phenyl)-2,2-dimethyl-propan-1-one;SCHEMBL2625461;DTXSID50478816;AKOS010258929;CS-0363374;N13954

Suppliers and Price of 1-(2-Chlorophenyl)-2,2-dimethylpropan-1-one

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

Rieke Metals
2'-Chloro-2,2-dimethylpropiophenone 97%
1g
$ 417.00

Rieke Metals
2'-Chloro-2,2-dimethylpropiophenone 97%
2g
$ 731.00

Rieke Metals
2'-Chloro-2,2-dimethylpropiophenone 97%
5g
$ 1514.00

Matrix Scientific
2'-Chloro-2,2-dimethylpropiophenone
5g
$ 1412.00

Matrix Scientific
2'-Chloro-2,2-dimethylpropiophenone
2g
$ 726.00

Matrix Scientific
2'-Chloro-2,2-dimethylpropiophenone
1g
$ 437.00

Crysdot
2'-Chloro-2,2-dimethylpropiophenone 95+%
1g
$ 433.00

Crysdot
2'-Chloro-2,2-dimethylpropiophenone 95+%
5g
$ 1401.00

American Custom Chemicals Corporation
2'-CHLORO-2,2-DIMETHYLPROPIOPHENONE 95.00%
10G
$ 3395.70

American Custom Chemicals Corporation
2'-CHLORO-2,2-DIMETHYLPROPIOPHENONE 95.00%
5G
$ 2243.59

Total 4 raw suppliers

Chemical Property of 1-(2-Chlorophenyl)-2,2-dimethylpropan-1-one

Chemical Property:

Vapor Pressure:0.0351mmHg at 25°C
Boiling Point:241.9oC at 760 mmHg
Flash Point:137.8oC
PSA：17.07000
Density:1.077g/cm3
LogP:3.56880
XLogP3:3.5
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:2
Exact Mass:196.0654927
Heavy Atom Count:13
Complexity:193

Purity/Quality:

96% ^*data from raw suppliers

2'-Chloro-2,2-dimethylpropiophenone 97% ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:CC(C)(C)C(=O)C1=CC=CC=C1Cl

Technology Process of 1-(2-Chlorophenyl)-2,2-dimethylpropan-1-one

There total 7 articles about 1-(2-Chlorophenyl)-2,2-dimethylpropan-1-one 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: 94.0%

: 694-80-4
2-bromo-1-chlorobenzene

: 3282-30-2
pivaloyl chloride

: 61593-17-7
1-(2-chloro-phenyl)-2,2-dimethyl-propan-1-one

Guidance literature:: 2-bromo-1-chlorobenzene; With TurboGrignard; In tetrahydrofuran; at -15 ℃; for 2.5h;

In tetrahydrofuran; at -20 ℃; for 0.166667h;

pivaloyl chloride; In tetrahydrofuran; at -10 ℃; for 20h; Further stages.;
DOI:10.1055/s-2006-950290

Reference yield: 75.0%

: 938-16-9
2,2-dimethylpropiophenone

: 61593-17-7
1-(2-chloro-phenyl)-2,2-dimethyl-propan-1-one

Guidance literature:: With dipotassium peroxodisulfate; N-chloro-succinimide; trifluorormethanesulfonic acid; palladium diacetate; In 1,2-dichloro-ethane; at 80 ℃; for 8h; regioselective reaction; Sealed tube;
DOI:10.1002/anie.201300176

Reference yield: 72.0%

: 2259-30-5
tert-butylmagnesium bromide

: 609-65-4
o-chlorobenzoyl chloride

: 61593-17-7
1-(2-chloro-phenyl)-2,2-dimethyl-propan-1-one

Guidance literature:: tert-butylmagnesium bromide; With CuCN*2LiCl; In tetrahydrofuran; at -40 ℃; for 0.25h;

o-chlorobenzoyl chloride; In tetrahydrofuran; at -40 - -5 ℃;
DOI:10.1021/ol048842g