4-Chloro-2-phenylsulfanylbenzoic acid

Base Information

Chemical Name:4-Chloro-2-phenylsulfanylbenzoic acid
CAS No.:13421-07-3
Molecular Formula:C13H9ClO2S
Molecular Weight:264.732
Hs Code.:
DSSTox Substance ID:DTXSID70548368
Wikidata:Q82427062
Mol file:13421-07-3.mol

Synonyms:4-Chloro-2-phenylsulfanylbenzoic acid;13421-07-3;Benzoic acid, 4-chloro-2-(phenylthio)-;4-chloro-2-(phenylthio)benzoic acid;SCHEMBL5798490;DTXSID70548368;PLYPQBMNAHHULI-UHFFFAOYSA-N;AKOS012382970;4-Chloro-2-(phenylsulfanyl)benzoic acid;A1-05424

Suppliers and Price of 4-Chloro-2-phenylsulfanylbenzoic 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 4-Chloro-2-phenylsulfanylbenzoic acid

Chemical Property:

XLogP3:4.1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:3
Exact Mass:264.0011784
Heavy Atom Count:17
Complexity:266

Purity/Quality:: 98%min ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1=CC=C(C=C1)SC2=C(C=CC(=C2)Cl)C(=O)O

Technology Process of 4-Chloro-2-phenylsulfanylbenzoic acid

There total 4 articles about 4-Chloro-2-phenylsulfanylbenzoic 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: 99.0%

: 13421-13-1
4-chloro-2-iodobenzoic acid

: 108-98-5
thiophenol

: 13421-07-3
4-chloro-2-(phenylsulfanyl)benzoic acid

Guidance literature:: With potassium hydroxide; copper; In water; at 120 ℃; for 8h;
DOI:10.1016/j.bmcl.2007.07.103

Reference yield:

: 6280-88-2
4-chloro-2-nitro-benzoic acid

: 13421-07-3
4-chloro-2-(phenylsulfanyl)benzoic acid

Guidance literature:: Multi-step reaction with 3 steps

1: H₂ / PtO₂ / methanol

2: (i) NaNO₂, aq. HCl, (ii) KI, aq. H₂SO₄

3: aq. KOH / Cu

With potassium hydroxide; hydrogen; platinum(IV) oxide; copper; In methanol;

Reference yield:

: 89-77-0
2-Amino-4-chlorobenzoic acid

: 13421-07-3
4-chloro-2-(phenylsulfanyl)benzoic acid

Guidance literature:: Multi-step reaction with 2 steps

1: (i) NaNO₂, aq. HCl, (ii) KI, aq. H₂SO₄

2: aq. KOH / Cu

With potassium hydroxide; copper;