4-Methoxy-3-(methylthio)benzoic acid

Base Information

Chemical Name:4-Methoxy-3-(methylthio)benzoic acid
CAS No.:87346-53-0
Molecular Formula:C9H10O3S
Molecular Weight:198.23900
Hs Code.:
DSSTox Substance ID:DTXSID10452132
Wikidata:Q82272540

Synonyms:4-methoxy-3-(methylthio)benzoic acid;87346-53-0;4-Methoxy-3-methylsulfanylbenzoic acid;SCHEMBL4455295;DTXSID10452132;IKLIRIKNLSNYOF-UHFFFAOYSA-N;4-methoxy-3-(methylthio)benzoicacid;MFCD20640312;BS-24050;CS-0195850;4-METHOXY-3-(METHYLSULFANYL)BENZOIC ACID

Suppliers and Price of 4-Methoxy-3-(methylthio)benzoic 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

Matrix Scientific
4-Methoxy-3-(methylthio)benzoic acid
500mg
$ 1200.00

Matrix Scientific
4-Methoxy-3-(methylthio)benzoic acid
1g
$ 1920.00

Crysdot
4-Methoxy-3-(methylthio)benzoicacid 97%
1g
$ 1310.00

Total 6 raw suppliers

Chemical Property of 4-Methoxy-3-(methylthio)benzoic acid

Chemical Property:

PSA：71.83000
LogP:2.11530
XLogP3:2.2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:3
Exact Mass:198.03506535
Heavy Atom Count:13
Complexity:184

Purity/Quality:

97% ^*data from raw suppliers

4-Methoxy-3-(methylthio)benzoic acid ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:COC1=C(C=C(C=C1)C(=O)O)SC

Technology Process of 4-Methoxy-3-(methylthio)benzoic acid

There total 5 articles about 4-Methoxy-3-(methylthio)benzoic 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:

: 77-78-1
dimethyl sulfate

: 3-mercapto-4-methoxy-benzoic acid ethyl ester

: 87346-53-0
4-methoxy-3-methylsulphenylbenzoic acid

Guidance literature:: With 10percent NaOH; at 20 ℃; for 2h;
DOI:10.1021/jm020873z

Reference yield:

: 77-78-1
dimethyl sulfate

: 262589-79-7
3-chlorosulfonyl-4-methoxybenzoic acid ethyl ester

: 87346-53-0
4-methoxy-3-methylsulphenylbenzoic acid

Guidance literature:: 3-chlorosulfonyl-4-methoxybenzoic acid ethyl ester; With triphenylphosphine; In toluene; at 20 ℃; for 4.5h;

dimethyl sulfate; In water; at 20 ℃; for 2h;

With hydrogenchloride; In water; pH=1;

Reference yield:

: 50803-29-7
3-chlorosulfonyl-4-methoxybenzoic acid

: 87346-53-0
4-methoxy-3-methylsulphenylbenzoic acid

Guidance literature:: Multi-step reaction with 2 steps

1: tin; aqueous hydrochloric acid

2: aq. NaOH solution

With hydrogenchloride; sodium hydroxide; tin;
DOI:10.1039/jr9330001375