1-(9-Phenanthryl)-1-cyclohexanol

Base Information

• Chemical Name: 1-(9-Phenanthryl)-1-cyclohexanol
• CAS No.: 10468-81-2
• Molecular Formula: C20H20O
• Molecular Weight: 276.378
• European Community (EC) Number: 661-421-9
• DSSTox Substance ID: DTXSID90399652
• Wikidata: Q82202323
• Mol file: 10468-81-2.mol

Synonyms:1-(9-phenanthryl)-1-cyclohexanol;10468-81-2;1-phenanthren-9-ylcyclohexan-1-ol;BIDD:GT0251;DTXSID90399652;AKOS024340991

Chemical Property of 1-(9-Phenanthryl)-1-cyclohexanol

Chemical Property:

• XLogP3: 5.1
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 1
• Exact Mass: 276.151415257
• Heavy Atom Count: 21
• Complexity: 357

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1CCC(CC1)(C2=CC3=CC=CC=C3C4=CC=CC=C42)O

Technology Process of 1-(9-Phenanthryl)-1-cyclohexanol

There total 2 articles about 1-(9-Phenanthryl)-1-cyclohexanol 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: 59.0%

9-bromophenanthrene (573-17-1) + cyclohexanone (108-94-1,11119-77-0,9003-41-2,9075-99-4) → 1-(phenanthren-9-yl)cyclohexan-1-ol (10468-81-2)

Guidance literature:

9-bromophenanthrene; With n-butyllithium; In tetrahydrofuran; hexane; at -78 ℃;

cyclohexanone; In tetrahydrofuran; hexane; at -78 ℃;

DOI:10.1021/jacs.9b12490

Reference yield:

9-phenanthrylmagnesium bromide (71112-64-6) + cyclohexanone (108-94-1,11119-77-0,9003-41-2,9075-99-4) → 1-(phenanthren-9-yl)cyclohexan-1-ol (10468-81-2)

Guidance literature:

In tetrahydrofuran; for 0.333333h;

DOI:10.1021/jm00167a027

Reference yield: 51.0%

1-(phenanthren-9-yl)cyclohexan-1-ol (10468-81-2) + para-bromoacetophenone (99-90-1) → 6-(4-acetylphenyl)-1-(phenanthren-9-yl)hexan-1-one

Guidance literature:

With 2,4,6-trimethyl-pyridine; [nickel(II)dichloride(dimethoxyethane)]; 4,4'-di-tert-butyl-2,2'-bipyridine; 9-(2-mesityl)-10-methylacridinium perchlorate; In 1,2-dichloro-ethane; at 20 ℃; for 60h; Sealed tube; Inert atmosphere; Irradiation;

DOI:10.1021/jacs.9b12490

upstream raw materials:

9-phenanthrylmagnesium bromide

cyclohexanone

9-bromophenanthrene

Downstream raw materials:

1-Phenanthren-9-yl-cyclohexylamine