Octahydro-2-phenyl-2H-1-benzothiopyran

Base Information

• Chemical Name: Octahydro-2-phenyl-2H-1-benzothiopyran
• CAS No.: 42873-19-8
• Molecular Formula: C15H20S
• Molecular Weight: 232.39
• DSSTox Substance ID: DTXSID701282755
• Mol file: 42873-19-8.mol

Synonyms:DTXSID701282755;AKOS000560328;Octahydro-2-phenyl-2H-1-benzothiopyran;42873-19-8

Chemical Property of Octahydro-2-phenyl-2H-1-benzothiopyran

Chemical Property:

• XLogP3: 4.6
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 1
• Exact Mass: 232.12857181
• Heavy Atom Count: 16
• Complexity: 220

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: C1CCC2C(C1)CCC(S2)C3=CC=CC=C3

Technology Process of Octahydro-2-phenyl-2H-1-benzothiopyran

There total 11 articles about Octahydro-2-phenyl-2H-1-benzothiopyran 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: 78.0%

2-phenyl-5,6-tetramethylene-4H-thiopyrane (53045-31-1) → cic,cis-2-phenyl-1-thiadecalin (42873-19-8,94668-50-5)

Guidance literature:

With hydrogen; palladium on activated charcoal; In ethanol; at 100 ℃; for 6h; under 38000 Torr;

DOI:10.1007/BF00476376

Reference yield: 69.0%

2-phenyl-5,6-tetramethylene-4H-thiopyrane (53045-31-1) → 2-Phenyl-cis-1-thiadecalin (42873-19-8)

Guidance literature:

With triethylsilane; trifluoroacetic acid; for 8h; Heating;

DOI:10.1007/BF00506959

Reference yield: 60.0%

trans-1-methoxy-3-phenyl-2-thiabicyclo<4.4.0>dec-3-ene (61273-06-1,102926-46-5) → 2-Phenyl-5,6-tetramethylenethiopyrylium perchlorate + cic,cis-2-phenyl-1-thiadecalin (42873-19-8,94668-50-5)

Guidance literature:

With perchloric acid; In acetic acid;

DOI:10.1007/BF00515021

upstream raw materials:

2-phenyl-5,6-tetramethylene-4H-thiopyrane

trifluoroacetic acid

2-(2-benzoylethyl)cyclohexanone

trans-1-methoxy-3-phenyl-2-thiabicyclo<4.4.0>dec-3-ene

Downstream raw materials:

2-Phenyl-octahydro-thiochromene 1-oxide

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