(2-{[4-Chloro-3-(trifluoromethyl)phenyl]sulfanyl}phenyl)acetic acid

Base Information

Chemical Name:(2-{[4-Chloro-3-(trifluoromethyl)phenyl]sulfanyl}phenyl)acetic acid
CAS No.:61150-44-5
Molecular Formula:C₁₅H₁₀ClF₃O₂S
Molecular Weight:346.757
Hs Code.:
DSSTox Substance ID:DTXSID70495020
Wikidata:Q82342852

Synonyms:(2-{[4-Chloro-3-(trifluoromethyl)phenyl]sulfanyl}phenyl)acetic acid;61150-44-5;SCHEMBL11489434;DTXSID70495020;JINZTZLHABAELU-UHFFFAOYSA-N

Suppliers and Price of (2-{[4-Chloro-3-(trifluoromethyl)phenyl]sulfanyl}phenyl)acetic acid

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

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Chemical Property of (2-{[4-Chloro-3-(trifluoromethyl)phenyl]sulfanyl}phenyl)acetic acid

Chemical Property:

XLogP3:5
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:4
Exact Mass:346.0042129
Heavy Atom Count:22
Complexity:392

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

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

Technology Process of (2-{[4-Chloro-3-(trifluoromethyl)phenyl]sulfanyl}phenyl)acetic acid

There total 8 articles about (2-{[4-Chloro-3-(trifluoromethyl)phenyl]sulfanyl}phenyl)acetic 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:

: 61150-43-4
2-(3-trifluoromethyl-4-chlorophenylthio)phenylacetonitrile

: 61150-44-5
[2-(4-Chloro-3-trifluoromethyl-phenylsulfanyl)-phenyl]-acetic acid

Guidance literature:: With potassium hydroxide;
DOI:10.1135/cccc19771705

Reference yield:

: 88-67-5
2-Iodobenzoic acid

: 61150-44-5
[2-(4-Chloro-3-trifluoromethyl-phenylsulfanyl)-phenyl]-acetic acid

Guidance literature:: Multi-step reaction with 5 steps

1: aq. KOH, Cu

2: NaBH₄, BF₃-Et₂O

3: SOCl₂, Py

5: aq. KOH

With pyridine; potassium hydroxide; sodium tetrahydroborate; thionyl chloride; boron trifluoride diethyl etherate; copper;
DOI:10.1135/cccc19771705

Reference yield:

: 61150-41-2
[2-(4-Chloro-3-trifluoromethyl-phenylsulfanyl)-phenyl]-methanol

: 61150-44-5
[2-(4-Chloro-3-trifluoromethyl-phenylsulfanyl)-phenyl]-acetic acid

Guidance literature:: Multi-step reaction with 3 steps

1: SOCl₂, Py

3: aq. KOH

With pyridine; potassium hydroxide; thionyl chloride;
DOI:10.1135/cccc19771705