2-(Hexyloxy)phenol

Base Information

• Chemical Name: 2-(Hexyloxy)phenol
• CAS No.: 31189-03-4
• Molecular Formula: C12H18O2
• Molecular Weight: 194.274
• DSSTox Substance ID: DTXSID80497131
• Wikidata: Q82346516
• Mol file: 31189-03-4.mol

Synonyms:2-(HEXYLOXY)PHENOL;31189-03-4;Phenol, 2-(hexyloxy)-;2-hexoxyphenol;2-hexyloxyphenol;1-hydroxy-2-hexyloxybenzene;SCHEMBL270163;DTXSID80497131;WTAUMGJJFXKZLQ-UHFFFAOYSA-N;A1-26292

Chemical Property of 2-(Hexyloxy)phenol

Chemical Property:

• PSA: 29.46000
• LogP: 3.35130
• XLogP3: 3.6
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 6
• Exact Mass: 194.130679813
• Heavy Atom Count: 14
• Complexity: 136

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CCCCCCOC1=CC=CC=C1O

Technology Process of 2-(Hexyloxy)phenol

There total 4 articles about 2-(Hexyloxy)phenol 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: 96.0%

1-bromo-hexane (111-25-1) + benzene-1,2-diol (120-80-9,19481-10-8,37349-32-9) → 2-(hexyloxy)phenol (31189-03-4)

Guidance literature:

With potassium carbonate; potassium iodide; In ethanol; at 85 ℃; for 60h;

Reference yield:

1-bromo-hexane (111-25-1) + benzene-1,2-diol (120-80-9,19481-10-8,37349-32-9) → 2-(hexyloxy)phenol (31189-03-4) + 1,2-dihexyloxybenzene (94259-20-8)

Guidance literature:

With potassium carbonate; In ethanol;

DOI:10.1021/ma300538h

Reference yield:

4-methylbenzenesulfonic acid n-hexylester (3839-35-8) + pyrocatechol monosodium salt (34789-97-4) → 2-(hexyloxy)phenol (31189-03-4)

Guidance literature:

With methanol;

upstream raw materials:

4-methylbenzenesulfonic acid n-hexylester

pyrocatechol monosodium salt

1-bromo-hexane

benzene-1,2-diol

Downstream raw materials:

2,3,6,7,10,11-hexakis(hexyloxy)triphenylene

2,3,6,7,10-penta(hexyloxy)-11-hydroxytriphenylene