4'-Methylsulfanyl-biphenyl-4-carboxylic acid

Base Information

Chemical Name:4'-Methylsulfanyl-biphenyl-4-carboxylic acid
CAS No.:728918-90-9
Molecular Formula:C₁₄H₁₂O₂S
Molecular Weight:244.314
Hs Code.:2930909090
European Community (EC) Number:673-772-5
DSSTox Substance ID:DTXSID00375008
Wikidata:Q82163560
Mol file:728918-90-9.mol

Synonyms:728918-90-9;4'-Methylsulfanyl-biphenyl-4-carboxylic acid;4-(4-methylsulfanylphenyl)benzoic Acid;4'-methylsulfanylbiphenyl-4-carboxylic acid;4'-(Methylthio)-[1,1'-biphenyl]-4-carboxylic acid;4'-(methylsulfanyl)[1,1'-biphenyl]-4-carboxylic acid;SCHEMBL3640502;DTXSID00375008;AKOS004118867;NCGC00374175-01;4'-(methylthio)biphenyl-4-carboxylic acid;BB 0223683;4'-(Methylthio)-[1,1'-biphenyl]-4-carboxylicacid

Suppliers and Price of 4'-Methylsulfanyl-biphenyl-4-carboxylic 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

Crysdot
4'-(Methylthio)-[1,1'-biphenyl]-4-carboxylicacid 97%
5g
$ 752.00

CHESS?
DP000158:4'-Methylsulfanyl-biphenyl-4-carboxylicacid 99
1 g
$ 216.00

American Custom Chemicals Corporation
4'-METHYLSULFANYL-BIPHENYL-4-CARBOXYLIC ACID 95.00%
1G
$ 1280.66

Total 8 raw suppliers

Chemical Property of 4'-Methylsulfanyl-biphenyl-4-carboxylic acid

Chemical Property:

Boiling Point:428.9oC at 760 mmHg
Flash Point:213.2oC
PSA：62.60000
LogP:3.77370
XLogP3:4.4
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:3
Exact Mass:244.05580079
Heavy Atom Count:17
Complexity:251

Purity/Quality:

97% ^*data from raw suppliers

4'-(Methylthio)-[1,1'-biphenyl]-4-carboxylicacid 97% ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CSC1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)O

Technology Process of 4'-Methylsulfanyl-biphenyl-4-carboxylic acid

There total 1 articles about 4'-Methylsulfanyl-biphenyl-4-carboxylic 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: 94.0%

: 104-95-0
(4-bromophenyl)thioanisole

: 14047-29-1
4-carboxyphenylboronic acid

: 728918-90-9
4'-(methylsulfanyl)biphenyl-4-carboxylic acid

Guidance literature:: With potassium carbonate; tetrakis(triphenylphosphine) palladium⁽⁰⁾; In 1,2-dimethoxyethane; water; at 80 ℃; for 18h;
DOI:10.1080/15421400601027981

Reference yield: 25.0%

: 728918-90-9
4'-(methylsulfanyl)biphenyl-4-carboxylic acid

: 649770-58-1
4'-mercapto-biphenyl-4-carboxylic acid

Guidance literature:: 4'-(methylsulfanyl)biphenyl-4-carboxylic acid; With 1-methyl-pyrrolidin-2-one; sodium thiomethoxide; at 100 ℃; for 48h;

With hydrogenchloride; for 1h;
DOI:10.1080/15421400601027981

Reference yield:

: 728918-90-9
4'-(methylsulfanyl)biphenyl-4-carboxylic acid

: 114879-31-1
4-sulfobiphenyl-4'-carboxylic acid

Guidance literature:: Multi-step reaction with 2 steps

1.1: sodium thiomethoxide; N-methylpyrrolidin-2-one / 48 h / 100 °C

1.2: 25 percent / aq. HCl / 1 h

2.1: air; gold / 5 h / UV-irradiation; self-assembled monolayer

With 1-methyl-pyrrolidin-2-one; air; sodium thiomethoxide; gold;
DOI:10.1080/15421400601027981