{2-[(4-Chlorophenyl)sulfanyl]-4-nitrophenyl}acetic acid

Base Information

Chemical Name:{2-[(4-Chlorophenyl)sulfanyl]-4-nitrophenyl}acetic acid
CAS No.:66949-44-8
Molecular Formula:C₁₄H₁₀ClNO₄S
Molecular Weight:323.757
Hs Code.:
DSSTox Substance ID:DTXSID501228799
Mol file:66949-44-8.mol

Synonyms:{2-[(4-chlorophenyl)sulfanyl]-4-nitrophenyl}acetic acid;Oprea1_035136;AE-641/30104006;2-[2-(4-chlorophenyl)sulfanyl-4-nitrophenyl]acetic acid;DTXSID501228799;66949-44-8;2-[(4-Chlorophenyl)thio]-4-nitrobenzeneacetic acid

Suppliers and Price of {2-[(4-Chlorophenyl)sulfanyl]-4-nitrophenyl}acetic 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 0 raw suppliers

Chemical Property of {2-[(4-Chlorophenyl)sulfanyl]-4-nitrophenyl}acetic acid

Chemical Property:

XLogP3:3.9
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:4
Exact Mass:323.0019067
Heavy Atom Count:21
Complexity:382

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:C1=CC(=CC=C1SC2=C(C=CC(=C2)[N+](=O)[O-])CC(=O)O)Cl

Technology Process of {2-[(4-Chlorophenyl)sulfanyl]-4-nitrophenyl}acetic acid

There total 3 articles about {2-[(4-Chlorophenyl)sulfanyl]-4-nitrophenyl}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:

: 16426-64-5
2-bromo-4-nitrobenzoic acid

: 66949-44-8
[2-(4-Chloro-phenylsulfanyl)-4-nitro-phenyl]-acetic acid

Guidance literature:: Multi-step reaction with 3 steps

1: K₂CO₃, Cu / hexamethylphosphoric acid triamide / 170 °C

2: (i) SOCl₂, (ii) /BRN= 102415/, Et₂O, CH₂Cl₂

3: aq. Ag₂O / dioxane

With copper; potassium carbonate; silver(l) oxide; In 1,4-dioxane; N,N,N,N,N,N-hexamethylphosphoric triamide;
DOI:10.1135/cccc19780471

Reference yield:

: 66949-30-2
2-(4-chloro-phenylsulfanyl)-4-nitro-benzoic acid

: 66949-44-8
[2-(4-Chloro-phenylsulfanyl)-4-nitro-phenyl]-acetic acid

Guidance literature:: Multi-step reaction with 2 steps

1: (i) SOCl₂, (ii) /BRN= 102415/, Et₂O, CH₂Cl₂

2: aq. Ag₂O / dioxane

With silver(l) oxide; In 1,4-dioxane;
DOI:10.1135/cccc19780471

Reference yield:

: 106-54-7
p-Chlorothiophenol

: 66949-44-8
[2-(4-Chloro-phenylsulfanyl)-4-nitro-phenyl]-acetic acid

Guidance literature:: Multi-step reaction with 3 steps

1: K₂CO₃, Cu / hexamethylphosphoric acid triamide / 170 °C

2: (i) SOCl₂, (ii) /BRN= 102415/, Et₂O, CH₂Cl₂

3: aq. Ag₂O / dioxane

With copper; potassium carbonate; silver(l) oxide; In 1,4-dioxane; N,N,N,N,N,N-hexamethylphosphoric triamide;
DOI:10.1135/cccc19780471