Benzene, 1-(cyclohexyloxy)-2-methyl-

Base Information

• Chemical Name: Benzene, 1-(cyclohexyloxy)-2-methyl-
• CAS No.: 67698-81-1
• Molecular Formula: C13H18O
• Molecular Weight: 190.285
• DSSTox Substance ID: DTXSID20364217
• Nikkaji Number: J1.965.549K
• Wikidata: Q82148049
• Mol file: 67698-81-1.mol

Synonyms:Benzene, 1-(cyclohexyloxy)-2-methyl-;67698-81-1;SCHEMBL10525480;Cyclohexyl(2-methylphenyl) ether;DTXSID20364217;1-(cyclohexyloxy)-2-methylbenzene;AKOS008967336

Chemical Property of Benzene, 1-(cyclohexyloxy)-2-methyl-

Chemical Property:

• XLogP3: 4.5
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 2
• Exact Mass: 190.135765193
• Heavy Atom Count: 14
• Complexity: 161

Purity/Quality:

85.0-99.8% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=CC=CC=C1OC2CCCCC2

Technology Process of Benzene, 1-(cyclohexyloxy)-2-methyl-

There total 11 articles about Benzene, 1-(cyclohexyloxy)-2-methyl- 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: 85.0%

ortho-methylphenyl iodide (615-37-2) + cyclohexanol (108-93-0) → 1-(cyclohexyloxy)-2-methylbenzene (67698-81-1)

Guidance literature:

With caesium carbonate; In neat (no solvent); at 110 ℃; for 36h; Inert atmosphere; Sealed tube;

DOI:10.1039/c6ra19825b

Reference yield: 78.0%

2-Methylcyclohexanone (583-60-8) + cyclohexanol (108-93-0) → 1-(cyclohexyloxy)-2-methylbenzene (67698-81-1)

Guidance literature:

With ethene; 5%-palladium/activated carbon; at 130 ℃; for 48h; under 760.051 Torr;

DOI:10.1002/ejoc.201601362

Reference yield: 76.8%

ortho-cresol (95-48-7,77504-84-8) + cyclohexene (110-83-8) → 1-(cyclohexyloxy)-2-methylbenzene (67698-81-1) + 4-Cyclohexyl-2-methyl-phenol (10366-14-0) + 2-methyl-6-cyclohexylphenol (4855-68-9) + 4,6-dicyclohexyl-2-methylphenol (2130-63-4) + 3,6-dicyclohexyl-2-methylphenol (114855-84-4)

Guidance literature:

With o-cresol; aluminium (III)-compound; at 200 ℃; for 6h; Product distribution; oth. temperature, oth. time, var. ratios of reagents;

upstream raw materials:

ortho-cresol

cyclohexene

cyclohexyl chloride

cyclohexanol

Downstream raw materials:

4-Cyclohexyl-2-methyl-phenol

2-methyl-6-cyclohexylphenol

ortho-cresol