4-(Phenylthio)-2(5H)-furanone

Base Information

• Chemical Name: 4-(Phenylthio)-2(5H)-furanone
• CAS No.: 57061-30-0
• Molecular Formula: C10H8O2S
• Molecular Weight: 192.23432
• Hs Code.: 2932190090
• DSSTox Substance ID: DTXSID90451249
• Nikkaji Number: J754.014K
• Wikidata: Q82271181
• Mol file: 57061-30-0.mol

Synonyms:4-(Phenylthio)-2(5H)-furanone;57061-30-0;3-phenylsulfanyl-2H-furan-5-one;4-phenylthio-2(5h)-furanone;SCHEMBL9062803;DTXSID90451249;AKOS006333871;SB61570;FT-0685864;J-513814

Chemical Property of 4-(Phenylthio)-2(5H)-furanone

Chemical Property:

• Vapor Pressure: 0mmHg at 25°C
• Boiling Point: 363.921°C at 760 mmHg
• Flash Point: 186.838°C
• PSA: 51.60000
• Density: 1.301g/cm³
• LogP: 2.21940
• XLogP3: 2
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 2
• Exact Mass: 192.02450067
• Heavy Atom Count: 13
• Complexity: 229

Purity/Quality:

98%min ^*data from raw suppliers

4-(Phenylthio)-2(5H)-furanone 96% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1C(=CC(=O)O1)SC2=CC=CC=C2

Technology Process of 4-(Phenylthio)-2(5H)-furanone

There total 7 articles about 4-(Phenylthio)-2(5H)-furanone 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: 90.0%

δ-phenylthio-γ-butyrolactone (52938-70-2) → 4-Phenylsulfanylfuran-2(5H)-one (57061-30-0)

Guidance literature:

With N-chloro-succinimide; In dichloromethane; for 16h;

DOI:10.1039/p19960001913

Reference yield: 43.0%

carbon monoxide (201230-82-2) + propargyl alcohol (107-19-7) + diphenyldisulfane (882-33-7) → 4-Phenylsulfanylfuran-2(5H)-one (57061-30-0) + (Z)-1,2-bis(phenylthio)-3-hydroxy-1-propene (137540-63-7)

Guidance literature:

tetrakis(triphenylphosphine) palladium⁽⁰⁾; In benzene; at 100 ℃; for 50h; under 45600 Torr;

DOI:10.1021/jo970973q

Reference yield: 17.0%

carbon monoxide (201230-82-2) + propargyl alcohol (107-19-7) + diphenyldisulfane (882-33-7) → 4-Phenylsulfanylfuran-2(5H)-one (57061-30-0) + 4-hydroxy-3-phenylsulfanyl-but-2-enethioic acid S-phenyl ester

Guidance literature:

tetrakis(triphenylphosphine) palladium⁽⁰⁾; In benzene; at 100 ℃; for 24h; under 45600 Torr;

DOI:10.1021/jo970973q

upstream raw materials:

δ-phenylthio-γ-butyrolactone

carbon monoxide

propargyl alcohol

diphenyldisulfane

Downstream raw materials:

3-phenylsulphonylbut-2-en-4-olide

4-(2-methoxycarbonylphenyl)-furan-2(5H)-one

4-(3-trifluoromethylphenyl)-furan-2(5H)-one

4-(2-methylphenyl)-furan-2(5H)-one