Benzene, 1,3-octadiynyl-

Base Information

Chemical Name:Benzene, 1,3-octadiynyl-
CAS No.:62217-45-2
Molecular Formula:C14H14
Molecular Weight:182.265
Hs Code.:
DSSTox Substance ID:DTXSID70440691
Nikkaji Number:J439.817C
Wikidata:Q82257061

Synonyms:Benzene, 1,3-octadiynyl-;62217-45-2;1-Phenyl-1,3-octadiyne;DTXSID70440691

Suppliers and Price of Benzene, 1,3-octadiynyl-

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-octadiynyl-

Chemical Property:

XLogP3:4.6
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:0
Rotatable Bond Count:4
Exact Mass:182.109550447
Heavy Atom Count:14
Complexity:266

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CCCCC#CC#CC1=CC=CC=C1

Technology Process of Benzene, 1,3-octadiynyl-

There total 26 articles about Benzene, 1,3-octadiynyl- 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: 90.0%

: phenylethynyl(phenyl)-λ³-iodane tetrafluoroborate

: 693-02-7
hex-1-yne

: 62217-45-2
1-phenylocta-1,3-diyne

Guidance literature:: With sodium hydrogencarbonate; palladium diacetate; In water; acetonitrile; for 0.333333h; Ambient temperature;
DOI:10.1039/cc9960000835

Reference yield: 89.0%

: 1-(hex-1-yn-1-yl)-3,3-bis(trifluoromethyl)-1,3-dihydro-1λ³-benzo[d][1,2]iodaoxole

: 536-74-3
phenylacetylene

: 62217-45-2
1-phenylocta-1,3-diyne

Guidance literature:: With 1,10-Phenanthroline; triazole; silver(I) 4-methylbenzenesulfonate; In acetonitrile; at 20 ℃; for 3h; Schlenk technique; Inert atmosphere;
DOI:10.1002/anie.201702833

Reference yield: 87.0%

: 693-02-7
hex-1-yne

: 1-Phenylethynyl-1H-1λ³-benzo[d][1,2]iodoxol-3-one

: 62217-45-2
1-phenylocta-1,3-diyne

Guidance literature:: hex-1-yne; With n-butyllithium; In tetrahydrofuran; hexane; at -78 ℃; for 2h; Inert atmosphere;

1-Phenylethynyl-1H-1λ³-benzo[d][1,2]iodoxol-3-one; In tetrahydrofuran; hexane; at -78 - 20 ℃; for 3h; Reagent/catalyst; Temperature; Inert atmosphere;
DOI:10.1039/c8ob02375a