2-(Benzenesulfinyl)cyclohexan-1-ol

Base Information

• Chemical Name: 2-(Benzenesulfinyl)cyclohexan-1-ol
• CAS No.: 65117-26-2
• Molecular Formula: C12H16 O2 S
• Molecular Weight: 224.324
• NSC Number: 170763
• DSSTox Substance ID: DTXSID10305432
• Mol file: 65117-26-2.mol

Synonyms:65117-26-2;2-(benzenesulfinyl)cyclohexan-1-ol;NSC170763;DTXSID10305432;NSC-170763

Chemical Property of 2-(Benzenesulfinyl)cyclohexan-1-ol

Chemical Property:

• Vapor Pressure: 1.07E-07mmHg at 25°C
• Boiling Point: 417°Cat760mmHg
• Flash Point: 206°C
• Density: 1.25g/cm³
• XLogP3: 2.1
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 2
• Exact Mass: 224.08710092
• Heavy Atom Count: 15
• Complexity: 224

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1CCC(C(C1)O)S(=O)C2=CC=CC=C2

Technology Process of 2-(Benzenesulfinyl)cyclohexan-1-ol

There total 10 articles about 2-(Benzenesulfinyl)cyclohexan-1-ol 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: 89.0%

(1R*,2R*)-2-thiophenylcyclohexanol (14032-04-3) → 2-Phenylsulfinyl-cyclohexanol (65117-26-2)

Guidance literature:

With dihydrogen peroxide; gallium(III) triflate; at 30 ℃; for 0.416667h;

DOI:10.1021/jo0700124

Reference yield: 88.0%

cyclohexane-1,2-epoxide (286-20-4) + thiophenol (108-98-5) → 2-Phenylsulfinyl-cyclohexanol (65117-26-2)

Guidance literature:

With dihydrogen peroxide; gallium(III) triflate; at 30 ℃; for 0.5h;

DOI:10.1021/jo0700124

Reference yield: 46.0%

cyclohexane-1,2-epoxide (286-20-4) + thiophenol (108-98-5) → 2-Phenylsulfinyl-cyclohexanol (65117-26-2) + diphenyldisulfane (882-33-7)

Guidance literature:

With dihydrogen peroxide; scandium tris(trifluoromethanesulfonate); at 30 ℃; for 12h;

DOI:10.1021/jo0700124

upstream raw materials:

(1R*,2R*)-2-thiophenylcyclohexanol

thiophenol

cyclohexene

trans-2-phenylthiocyclohexanol

Downstream raw materials:

(1R*,2R*)-2-thiophenylcyclohexanol