3-(4-Chlorophenyl)-2,2-dimethylpropanoic acid

Base Information

Chemical Name:3-(4-Chlorophenyl)-2,2-dimethylpropanoic acid
CAS No.:57145-14-9
Molecular Formula:C₁₁H₁₃ClO₂
Molecular Weight:212.676
Hs Code.:
European Community (EC) Number:846-019-5

Synonyms:57145-14-9;3-(4-chlorophenyl)-2,2-dimethylpropanoic acid;Benzenepropanoic acid, 4-chloro-a,a-dimethyl-;SCHEMBL6469200;BTCKPHZRFQRLHP-UHFFFAOYSA-N;AKOS012031706;CS-0242534;3-(4-chlorophenyl)-2,2-dimethylpropanoicacid;EN300-251325;3-(4-chlorophenyl)-2,2-dimethyl-propionic acid;Benzenepropanoic acid, 4-chloro-alpha,alpha-dimethyl-;F2147-6211;Z995179626

Suppliers and Price of 3-(4-Chlorophenyl)-2,2-dimethylpropanoic acid

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

Total 4 raw suppliers

Chemical Property of 3-(4-Chlorophenyl)-2,2-dimethylpropanoic acid

Chemical Property:

XLogP3:3.2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:3
Exact Mass:212.0604073
Heavy Atom Count:14
Complexity:205

Purity/Quality:: 99% ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:CC(C)(CC1=CC=C(C=C1)Cl)C(=O)O

Technology Process of 3-(4-Chlorophenyl)-2,2-dimethylpropanoic acid

There total 3 articles about 3-(4-Chlorophenyl)-2,2-dimethylpropanoic acid 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:

: 14305-27-2
3-(4-chlorophenyl)-2,2-dimethylpropanoic acid methyl ester

: 57145-14-9
α-(4-Chloro-benzyl)-isobutyric acid

Guidance literature:: 3-(4-chlorophenyl)-2,2-dimethylpropanoic acid methyl ester; With water; sodium hydroxide; In methanol; at 60 ℃;

With hydrogenchloride; In methanol; water; pH=2;
DOI:10.1021/ja2001709

Reference yield:

: 622-95-7
4-chlorobenzyl bromide

: 57145-14-9
α-(4-Chloro-benzyl)-isobutyric acid

Guidance literature:: Multi-step reaction with 2 steps

1.1: n-butyllithium; diisopropylamine / tetrahydrofuran; hexane / 1 h / -78 °C

1.2: 16 h / -78 - 20 °C

1.3: 0 °C

2.1: water; sodium hydroxide / methanol / 60 °C

2.2: pH 2

With n-butyllithium; water; diisopropylamine; sodium hydroxide; In tetrahydrofuran; methanol; hexane;
DOI:10.1021/ja2001709