2-(2-Fluorophenyl)sulfanylbenzoic acid

Base Information

Chemical Name:2-(2-Fluorophenyl)sulfanylbenzoic acid
CAS No.:87033-71-4
Molecular Formula:C13H9FO2S
Molecular Weight:248.27300
Hs Code.:
DSSTox Substance ID:DTXSID40356593
Wikidata:Q82136032

Synonyms:2-(2-fluorophenyl)sulfanylbenzoic acid;87033-71-4;Benzoic acid, 2-[(2-fluorophenyl)thio]-;AE-641/04640053;2-[(2-fluorophenyl)sulfanyl]benzoic acid;DTXSID40356593;AKOS005068050;A1-05307

Suppliers and Price of 2-(2-Fluorophenyl)sulfanylbenzoic 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
2-(2-Fluorophenyl)sulfanylbenzoic acid 95%
2.500g
$ 1403.00

A1 Biochem Labs
2-(2-Fluorophenyl)sulfanylbenzoicacid 95%
2.5 g
$ 850.00

Total 0 raw suppliers

Chemical Property of 2-(2-Fluorophenyl)sulfanylbenzoic acid

Chemical Property:

PSA：62.60000
LogP:3.67510
XLogP3:3.8
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:3
Exact Mass:248.03072886
Heavy Atom Count:17
Complexity:272

Purity/Quality:: 2-(2-Fluorophenyl)sulfanylbenzoic acid 95% ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1=CC=C(C(=C1)C(=O)O)SC2=CC=CC=C2F

Technology Process of 2-(2-Fluorophenyl)sulfanylbenzoic acid

There total 2 articles about 2-(2-Fluorophenyl)sulfanylbenzoic 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: 81.0%

: 147-93-3
Thiosalicylic acid

: 87033-71-4
2-((2-fluorophenyl)thio)benzoic acid

Guidance literature:: With copper; potassium carbonate; In N,N-dimethyl-formamide; at 120 ℃; for 12h;
DOI:10.1021/acs.jmedchem.7b01134

Reference yield:

: 88-67-5
2-Iodobenzoic acid

: 2557-78-0
2-fluorothiophenol

: 87033-71-4
2-((2-fluorophenyl)thio)benzoic acid

Guidance literature:: With potassium hydroxide; copper; Yield given. Multistep reaction; 1.) water, 10 min, 50 deg C, 2.) reflux 10 h.;
DOI:10.1135/cccc19831187

Reference yield: 97.0%

: 87033-71-4
2-((2-fluorophenyl)thio)benzoic acid

: 87033-72-5
2-(2-fluorophenylthio)benzyl alcohol

Guidance literature:: With sodium tetrahydroborate; boron trifluoride diethyl etherate; In tetrahydrofuran; 1.) 20-30 deg C, 35 min, 2.) 4 h, R_.T_.;
DOI:10.1135/cccc19831187