Methyl 4-(2-oxopropyl)benzoate

Base Information

Chemical Name:Methyl 4-(2-oxopropyl)benzoate
CAS No.:22744-50-9
Molecular Formula:C11H12O3
Molecular Weight:192.214
Hs Code.:
DSSTox Substance ID:DTXSID60456569
Nikkaji Number:J3.662.709C
Wikidata:Q82279121
Mol file:22744-50-9.mol

Synonyms:Methyl 4-(2-oxopropyl)benzoate;22744-50-9;4-(2-OXO-PROPYL)-BENZOIC ACID METHYL ESTER;1-(p-carboMethoxyphenyl)-2-propanone;Methyl4-(2-oxopropyl)benzoate;SCHEMBL7151482;DTXSID60456569;MMLNFWPLMKLQFK-UHFFFAOYSA-N;XAA74450;MFCD11858308;1-(4-carbomethoxyphenyl)propan-2-one;SB35606;1-(4-carbomethoxyphenyl) propan-2-one;4-(2-Oxopropyl)benzoic acid methyl ester;CS-0272135;FT-0709981;J3.662.709C;EN300-1829916

Suppliers and Price of Methyl 4-(2-oxopropyl)benzoate

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-(2-Oxo-propyl)-benzoicAcidmethylester
10mg
$ 45.00

Sigma-Aldrich
(2-Oxo-1(2H)-quinolinyl)acetic acid AldrichCPR
1 g
$ 145.00

J&W Pharmlab
4-(2-Oxo-propyl)-benzoicacidmethylester 96%
50mg
$ 131.00

American Custom Chemicals Corporation
4-(2-OXO-PROPYL)-BENZOIC ACID METHYL ESTER 96.00%
5MG
$ 502.37

Total 8 raw suppliers

Chemical Property of Methyl 4-(2-oxopropyl)benzoate

Chemical Property:

PSA：43.37000
LogP:1.60470
XLogP3:2
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:4
Exact Mass:192.078644241
Heavy Atom Count:14
Complexity:215

Purity/Quality:

97% ^*data from raw suppliers

4-(2-Oxo-propyl)-benzoicAcidmethylester ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

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

Technology Process of Methyl 4-(2-oxopropyl)benzoate

There total 18 articles about Methyl 4-(2-oxopropyl)benzoate 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: 95.0%

: methyl-4-(prop-1-en-1-yl)benzoate

: 22744-50-9
1-(4-carbomethoxyphenyl)-propan-2-one

Guidance literature:: With chloropyridinecobaloxime(III); water; 9-(2-mesityl)-10-methylacridinium perchlorate; In acetonitrile; at 20 ℃; for 24h; regioselective reaction; Inert atmosphere; Schlenk technique; Irradiation;
DOI:10.1021/jacs.6b07411

Reference yield: 91.0%

: 1126-46-1
Methyl 4-chlorobenzoate

: 67-64-1
acetone

: 22744-50-9
1-(4-carbomethoxyphenyl)-propan-2-one

Guidance literature:: With bis[chloro(1,2,3-trihapto-allylbenzene)palladium(II)]; 2-methoxy-6-(N-methyl-N-phenyl-amino)phenyl(dicyclohexyl)phosphine; caesium carbonate; at 90 ℃; for 12h; Inert atmosphere; Schlenk technique; Sealed tube;
DOI:10.1002/adsc.201300207