1,3-Cyclohexadien-5-yne, 1,2,3,4-tetrafluoro-

Base Information

Chemical Name:1,3-Cyclohexadien-5-yne, 1,2,3,4-tetrafluoro-
CAS No.:5488-71-1
Molecular Formula:C6F4
Molecular Weight:148.06
Hs Code.:
DSSTox Substance ID:DTXSID70476652
Nikkaji Number:J1.218.573A
Wikidata:Q82308268

Synonyms:tetrafluorobenzyne;1,3-Cyclohexadien-5-yne, 1,2,3,4-tetrafluoro-;5488-71-1;DTXSID70476652

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

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Chemical Property of 1,3-Cyclohexadien-5-yne, 1,2,3,4-tetrafluoro-

Chemical Property:

PSA：0.00000
LogP:2.30460
XLogP3:1.2
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:0
Exact Mass:147.99361265
Heavy Atom Count:10
Complexity:102

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MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1#CC(=C(C(=C1F)F)F)F
General Description 1,3-Cyclohexadien-5-yne, 1,2,3,4-tetrafluoro- (also known as perfluorinated o-benzyne or 1,2-didehydro-3,4,5,6-tetrafluorobenzene) is a highly reactive intermediate formed through UV photolysis of tetrafluorophthalic anhydride in solid argon at low temperatures. It can be further carbonylated upon irradiation to yield a cyclopropenone derivative. 1,3-Cyclohexadien-5-yne, 1,2,3,4-tetrafluoro-, along with its meta-isomer, has been spectroscopically characterized using matrix isolation techniques and DFT calculations, confirming its structure and reactivity under cryogenic conditions. The formation and stability of this benzyne derivative are sensitive to the matrix environment, with distinct photochemical behavior observed in neon versus argon matrices.

Technology Process of 1,3-Cyclohexadien-5-yne, 1,2,3,4-tetrafluoro-

There total 8 articles about 1,3-Cyclohexadien-5-yne, 1,2,3,4-tetrafluoro- 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: