Benzene, 1,3,5-trioctyl-

Base Information

Chemical Name:Benzene, 1,3,5-trioctyl-
CAS No.:7694-77-1
Molecular Formula:C30H54
Molecular Weight:414.759
Hs Code.:
DSSTox Substance ID:DTXSID80467677
Nikkaji Number:J994.505I
Wikidata:Q82294726

Synonyms:Benzene, 1,3,5-trioctyl-;7694-77-1;DTXSID80467677

Suppliers and Price of Benzene, 1,3,5-trioctyl-

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

Manufacturers and distributors:

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Total 0 raw suppliers

Chemical Property of Benzene, 1,3,5-trioctyl-

Chemical Property:

Boiling Point:239-240 °C(Press: 2 Torr)
PSA：0.00000
Density:0.8525 g/cm3
LogP:10.39560
XLogP3:14.1
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:0
Rotatable Bond Count:21
Exact Mass:414.422551722
Heavy Atom Count:30
Complexity:269

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CCCCCCCCC1=CC(=CC(=C1)CCCCCCCC)CCCCCCCC

Technology Process of Benzene, 1,3,5-trioctyl-

There total 7 articles about Benzene, 1,3,5-trioctyl- 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: 95.0%

: 764-93-2
1-decyne

: 7694-77-1
1,3,5-trioctylbenzene

: 87969-80-0
1,2,4-trioctylbenzene

Guidance literature:: With potassium tert-butylate; 4,4,5,5-tetramethyl-[1,3,2]-dioxaboralane; cobalt(II) iodide; In acetonitrile; at 30 ℃; for 12h; regioselective reaction; Glovebox; Inert atmosphere;
DOI:10.1021/acs.orglett.1c02493

Reference yield: 76.0%

: 108-70-3,63697-19-8
1,3,5-trichlorobenzene

: 17049-49-9
octylmagnesium bromide

: 7694-77-1
1,3,5-trioctylbenzene

Guidance literature:: 1,2-bis(diphenylphosphino)ethane nickel(II) chloride; In diethyl ether; 1.) 18 h, 0 deg C to room temperature, 2.) 2 h, reflux;
DOI:10.1021/jo00177a018

Reference yield: 17.0%

: 764-93-2
1-decyne

: 15226-74-1,61091-28-9,61117-58-6
dicobalt octacarbonyl

: N,N,N'-trimethyl-N'-allylthiourea

: 201230-82-2
carbon monoxide

: 1235569-13-7
C₁₄H₂₂O

: 73317-94-9
11-methylene-9-nonadecyne

: 7694-77-1
1,3,5-trioctylbenzene

: 87969-80-0
1,2,4-trioctylbenzene

: (E)-Icos-9-en-11-yne

Guidance literature:: 1-decyne; dicobalt octacarbonyl; N,N,N'-trimethyl-N'-allylthiourea; With 1,1,3,3-tetramethyl-2-thiourea; In toluene; for 0.0833333h; Inert atmosphere;

carbon monoxide; In toluene; at 110 ℃; for 22h; under 2250.23 Torr; Autoclave;
DOI:10.1016/j.tetlet.2010.04.025