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

Base Information

• Chemical Name: 2,3,6,7,10,11-Hexakis(hexyloxy)triphenylene
• CAS No.: 70351-86-9
• Molecular Formula: C54H84O6
• Molecular Weight: 829.257
• DSSTox Substance ID: DTXSID90449060
• Nikkaji Number: J650.491D
• Wikidata: Q82268369
• Mol file: 70351-86-9.mol

Synonyms:2,3,6,7,10,11-hexakis(hexyloxy)triphenylene;70351-86-9;2,3,6,7,10,11-hexahexoxytriphenylene;Triphenylene, 2,3,6,7,10,11-hexakis(hexyloxy)-;SCHEMBL6743869;DTXSID90449060;MFCD16250223;AKOS037646155;AS-66987;H1449;T72853;2,3,6,7,10,11-hexakis[hexyloxy] triphenylene

Chemical Property of 2,3,6,7,10,11-Hexakis(hexyloxy)triphenylene

Chemical Property:

• PSA: 55.38000
• LogP: 16.90080
• XLogP3: 18.7
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 36
• Exact Mass: 828.62679039
• Heavy Atom Count: 60
• Complexity: 807

Purity/Quality:

97% ^*data from raw suppliers

2,3,6,7,10,11-Hexakis(hexyloxy)triphenylene >98.0%(HPLC) ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCCCOC1=C(C=C2C(=C1)C3=CC(=C(C=C3C4=CC(=C(C=C24)OCCCCCC)OCCCCCC)OCCCCCC)OCCCCCC)OCCCCCC

Technology Process of 2,3,6,7,10,11-Hexakis(hexyloxy)triphenylene

There total 22 articles about 2,3,6,7,10,11-Hexakis(hexyloxy)triphenylene 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: 94.0%

1,2-dihexyloxybenzene (94259-20-8) → 2,3,6,7,10,11-hexakis(hexyloxy)triphenylene (70351-86-9)

Guidance literature:

With molybdenum(V) chloride; In dichloromethane; for 0.333333h; Ambient temperature;

DOI:10.1039/a704130f

Reference yield: 77.0%

1,2-dihexyloxybenzene (94259-20-8) + 4,4'-bis(hexyloxy)-3,3'-dimethoxybiphenyl (160257-82-9) → 2,3,6,7,10,11-hexakis(hexyloxy)triphenylene (70351-86-9) + 3,6-dimethoxy-2,7,10,11-tetrakis(hexyloxy)triphenylene (155787-80-7)

Guidance literature:

With iron(III) chloride; In dichloromethane; for 1h; Ambient temperature;

DOI:10.1039/c39940000465

Reference yield: 75.0%

2-[3,4-bis(hexyloxy)phenyl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane (881209-78-5) → 2,3,6,7,10,11-hexakis(hexyloxy)triphenylene (70351-86-9)

Guidance literature:

With tetrakis(triphenylphosphine) palladium⁽⁰⁾; caesium carbonate; In toluene; at 150 ℃; for 0.666667h; Inert atmosphere; Microwave irradiation;

DOI:10.1021/cm903555s

upstream raw materials:

1,2-dihexyloxybenzene

1,2-dioctyloxybenzene

3,3′-di(hexyloxy)-4,4′-bis(methyloxy)biphenyl

4,4'-bis(hexyloxy)-3,3'-dimethoxybiphenyl

Downstream raw materials:

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

2,6,10-tri(hydroxy)-3,7,11-tris(hexyloxy)triphenylene

η(6)-2,3,6,7,10,11-hexahexyloxytriphenylene(1,1a,2,3,4,4a)-tricarbonyl-chromium(0)

3,6,7,10,11-pentakis(hexyloxy)triphenylen-2-yl 1,1,1-trifluoromethanesulfonate

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