1-(Difluoromethyl)-2,3,3,4,4,5,5,6,6-nonafluorocyclohex-1-ene

Base Information

• Chemical Name: 1-(Difluoromethyl)-2,3,3,4,4,5,5,6,6-nonafluorocyclohex-1-ene
• CAS No.: 10534-43-7
• Molecular Formula: C7HF11
• Molecular Weight: 294.067
• DSSTox Substance ID: DTXSID10547012
• Wikidata: Q82425004
• Mol file: 10534-43-7.mol

Synonyms:10534-43-7;1-(Difluoromethyl)-2,3,3,4,4,5,5,6,6-nonafluorocyclohex-1-ene;DTXSID10547012

Chemical Property of 1-(Difluoromethyl)-2,3,3,4,4,5,5,6,6-nonafluorocyclohex-1-ene

Chemical Property:

• XLogP3: 3.1
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 11
• Rotatable Bond Count: 1
• Exact Mass: 293.99025981
• Heavy Atom Count: 18
• Complexity: 390

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: C1(=C(C(C(C(C1(F)F)(F)F)(F)F)(F)F)F)C(F)F

Technology Process of 1-(Difluoromethyl)-2,3,3,4,4,5,5,6,6-nonafluorocyclohex-1-ene

There total 10 articles about 1-(Difluoromethyl)-2,3,3,4,4,5,5,6,6-nonafluorocyclohex-1-ene 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: 18.0%

2,3,4,5,6-pentafluorobenzyl fluoride (22006-43-5) → 1-(difluoromethyl)nonafluorocyclohex-1-ene (10534-43-7) + 1-fluoromethylnonafluorocyclohexene (111180-52-0) + 1-fluoromethylheptafluoro-1,4-cyclohexadiene (111180-51-9) + 1-difluoromethylheptafluoro-1,4-cyclohexadiene (111180-53-1)

Guidance literature:

With vanadium pentafluoride; In various solvent(s); at -30 - -25 ℃; Further byproducts given;

Reference yield:

difluoromethylpentafluorobenzene (22006-44-6) → perfluorotoluene (434-64-0) + 1-(difluoromethyl)nonafluorocyclohex-1-ene (10534-43-7) + 1-difluoromethylheptafluoro-1,4-cyclohexadiene (111180-53-1)

Guidance literature:

With vanadium pentafluoride; In various solvent(s); at -30 - -25 ℃; Product distribution; other molar ratio, other solvent;

Reference yield:

toluene (108-88-3,15644-74-3,16713-13-6) → perfluoro(methylcyclohexane) (355-02-2) + difluoromethylbenzene (455-31-2) + 1-(difluoromethyl)nonafluorocyclohex-1-ene (10534-43-7) + difluoromethylundecafluorocyclohexane

Guidance literature:

With caesium tetrafluorocobaltate(III); at 360 ℃; Further byproducts given;

DOI:10.1016/S0022-1139(00)83080-8

upstream raw materials:

2,3,4,5,6-pentafluorotoluene

phenylacetic acid

2,3,4,5,6-pentafluorobenzyl fluoride

difluoromethylpentafluorobenzene