3-(Benzenesulfonyl)-5-methyl-2-phenylfuran

Base Information

• Chemical Name: 3-(Benzenesulfonyl)-5-methyl-2-phenylfuran
• CAS No.: 132268-96-3
• Molecular Formula: C17H14O3S
• Molecular Weight: 298.362
• DSSTox Substance ID: DTXSID50563958
• Nikkaji Number: J531.411I
• Wikidata: Q82448511
• Mol file: 132268-96-3.mol

Synonyms:132268-96-3;5-Methyl-2-phenyl-3-(phenylsulfonyl)furan;3-(Benzenesulfonyl)-5-methyl-2-phenylfuran;DTXSID50563958

Chemical Property of 3-(Benzenesulfonyl)-5-methyl-2-phenylfuran

Chemical Property:

• XLogP3: 3.8
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 3
• Exact Mass: 298.06636548
• Heavy Atom Count: 21
• Complexity: 427

Purity/Quality:

85.0-99.8% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CC1=CC(=C(O1)C2=CC=CC=C2)S(=O)(=O)C3=CC=CC=C3

Technology Process of 3-(Benzenesulfonyl)-5-methyl-2-phenylfuran

There total 5 articles about 3-(Benzenesulfonyl)-5-methyl-2-phenylfuran 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: 94.0%

4-Benzenesulfonyl-2-iodomethyl-5-phenyl-2,3-dihydro-furan (132268-91-8) → 5-methyl-2-phenyl-3-(phenylsulfonyl)furan (132268-96-3)

Guidance literature:

With 1,8-diazabicyclo[5.4.0]undec-7-ene; In benzene; Heating;

Reference yield: 90.0%

4,5-dihydro-5-methylene-2-phenyl-3-(phenylsulfonyl)furan (146896-47-1) → 5-methyl-2-phenyl-3-(phenylsulfonyl)furan (132268-96-3)

Guidance literature:

With Amberlist; In benzene; for 3h; Ambient temperature;

DOI:10.1021/jo00058a011

Reference yield:

2-benzenesulfonyl-1-phenyl-pent-4-en-1-one (104869-91-2) → 5-methyl-2-phenyl-3-(phenylsulfonyl)furan (132268-96-3)

Guidance literature:

Multi-step reaction with 4 steps

1: 1)(NH₄)2S₂O₈

2: H₂O₂ / methanol / 4 h / Ambient temperature

3: 10percent NaHCO₃ / benzene / 7 h / Heating

4: 90 percent / amberlist / benzene / 3 h / Ambient temperature

With ammonium peroxydisulfate; Amberlist; dihydrogen peroxide; sodium hydrogencarbonate; In methanol; benzene;

DOI:10.1021/jo00058a011

upstream raw materials:

4-Benzenesulfonyl-2-iodomethyl-5-phenyl-2,3-dihydro-furan

4,5-dihydro-5-methylene-2-phenyl-3-(phenylsulfonyl)furan

2-benzenesulfonyl-1-phenyl-pent-4-en-1-one

4,5-dihydro-2-phenyl-5-<(phenylseleno)methyl>-3-(phenylsulfonyl)furan