Methyl 3-(phenylsulfanyl)benzoate

Base Information

Chemical Name:Methyl 3-(phenylsulfanyl)benzoate
CAS No.:40730-42-5
Molecular Formula:C14H12O2S
Molecular Weight:244.314
Hs Code.:
DSSTox Substance ID:DTXSID80507224
Wikidata:Q82363325
Mol file:40730-42-5.mol

Synonyms:Methyl 3-(phenylsulfanyl)benzoate;40730-42-5;methyl 3-phenylsulfanylbenzoate;SCHEMBL5316103;DTXSID80507224

Suppliers and Price of Methyl 3-(phenylsulfanyl)benzoate

Supply Marketing:

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

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Chemical Property of Methyl 3-(phenylsulfanyl)benzoate

Chemical Property:

XLogP3:4.3
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:4
Exact Mass:244.05580079
Heavy Atom Count:17
Complexity:249

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:COC(=O)C1=CC(=CC=C1)SC2=CC=CC=C2

Technology Process of Methyl 3-(phenylsulfanyl)benzoate

There total 8 articles about Methyl 3-(phenylsulfanyl)benzoate 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: 95.0%

: 618-91-7
methyl 3-iodo-benzoate

: 108-98-5
thiophenol

: 40730-42-5
methyl 3-phenylsulfanylbenzoate

Guidance literature:: With potassium carbonate; zinc; 1,1'-bis-(diphenylphosphino)ferrocene; nickel dibromide; In N,N-dimethyl-formamide; at 25 ℃; for 5h;
DOI:10.1246/cl.1987.2221

Reference yield: 87.0%

: 618-89-3
methyl 3-bromobenzoate

: 108-98-5
thiophenol

: 40730-42-5
methyl 3-phenylsulfanylbenzoate

Guidance literature:: With fac-tris[2-phenylpyridinato-C²,N]iridium(III); caesium carbonate; In N,N-dimethyl-formamide; at 25 ℃; for 9h; Schlenk technique; Inert atmosphere; Irradiation;
DOI:10.1002/anie.201610414

Reference yield: 80.0%

: 2905-65-9
methyl 3-chlorobenzoate

: 108-98-5
thiophenol

: 40730-42-5
methyl 3-phenylsulfanylbenzoate

Guidance literature:: With potassium tert-butylate; CyPF-t-Bu; bis(dibenzylideneacetone)-palladium⁽⁰⁾; In toluene; at 110 ℃;
DOI:10.1002/chem.200600949