6-(2-Cyclohexylethoxy)-3,4-dihydronaphthalen-1(2H)-one

Base Information

• Chemical Name: 6-(2-Cyclohexylethoxy)-3,4-dihydronaphthalen-1(2H)-one
• CAS No.: 88628-50-6
• Molecular Formula: C18H24O2
• Molecular Weight: 272.387
• DSSTox Substance ID: DTXSID20517145
• Wikidata: Q82378961
• Mol file: 88628-50-6.mol

Synonyms:88628-50-6;6-(2-Cyclohexylethoxy)-3,4-dihydro-2H-naphthalen-1-one;6-(2-Cyclohexylethoxy)-3,4-dihydronaphthalen-1(2H)-one;1(2H)-Naphthalenone, 6-(2-cyclohexylethoxy)-3,4-dihydro-;DTXSID20517145;A1-04953

Chemical Property of 6-(2-Cyclohexylethoxy)-3,4-dihydronaphthalen-1(2H)-one

Chemical Property:

• XLogP3: 5.1
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 4
• Exact Mass: 272.177630004
• Heavy Atom Count: 20
• Complexity: 319

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: C1CCC(CC1)CCOC2=CC3=C(C=C2)C(=O)CCC3

Technology Process of 6-(2-Cyclohexylethoxy)-3,4-dihydronaphthalen-1(2H)-one

There total 1 articles about 6-(2-Cyclohexylethoxy)-3,4-dihydronaphthalen-1(2H)-one 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: 100.0%

1-bromo-2-cyclohexylethane (1647-26-3) + 6-Hydroxy-1-tetralone (3470-50-6) → cyclohexylethoxynaphthalenone (88628-50-6)

Guidance literature:

With potassium carbonate; potassium iodide; In N,N-dimethyl-formamide; at 100 ℃; for 3h;

DOI:10.1248/cpb.31.2329

Reference yield: 44.0%

cyclohexylethoxynaphthalenone (88628-50-6) → 6-(2-Cyclohexyl-ethoxy)-3,4-dihydro-2H-naphthalen-1-one oxime (66361-91-9)

Guidance literature:

With hydroxylamine hydrochloride; potassium carbonate; In methanol; water; for 3h; Heating;

DOI:10.1248/cpb.31.2329

Reference yield:

cyclohexylethoxynaphthalenone (88628-50-6) → C25H31NO4S (66362-02-5)

Guidance literature:

Multi-step reaction with 2 steps

1: 44 percent / K₂CO₃/NH₂OH*HCl / methanol; H₂O / 3 h / Heating

2: 93 percent / pyridine / 5 deg C, 30 min, then rt., 1 h

With pyridine; hydroxylamine hydrochloride; potassium carbonate; In methanol; water;

DOI:10.1248/cpb.31.2329

upstream raw materials:

1-bromo-2-cyclohexylethane

6-Hydroxy-1-tetralone

Downstream raw materials:

6-(2-Cyclohexyl-ethoxy)-3,4-dihydro-2H-naphthalen-1-one oxime

C₂₅H₃₁NO₄S