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2,2-Bis(3,4-dimethylphenyl)hexafluoropropane

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CAS:65294-20-4
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2,2-Bis(3,4-dimethylphenyl)hexafluoropropane Basic information
Product Name:2,2-Bis(3,4-dimethylphenyl)hexafluoropropane
Synonyms:4,8-dimethoxy-9H-furo[2,3-b]quinolin-7-one;1,1’-[2,2,2-trifluoro-1-(trifluoromethyl)ethylidene]bis[3,4-dimethyl-benzen;4-[1-(3,4-Dimethylphenyl)-2,2,2-trifluoro-1-(trifluoromethyl)ethyl]-1,2-dimethylbenzene;Benzene, 1,1'-[2,2,2-trifluoro-1-(trifluoromethyl)ethylidene]bis[3,4-dimethyl-;Hexafluoro-2,2-bis-(3,4-dimethylphenyl)-propane;BIS-X-AF;2,2-BIS(3,4-DIMETHYLPHENYL)HEXAFLUOROPROPANE;4,4'-(HEXAFLUOROISOPROPYLIDENE)DI-O-XYLENE
CAS:65294-20-4
MF:C19H18F6
MW:360.34
EINECS:265-687-3
Product Categories:PI
Mol File:65294-20-4.mol
2,2-Bis(3,4-dimethylphenyl)hexafluoropropane Structure
2,2-Bis(3,4-dimethylphenyl)hexafluoropropane Chemical Properties
Melting point 76-78°C
Boiling point 110-120°C 2mm
density 1.198±0.06 g/cm3(Predicted)
Fp >110°C
storage temp. Sealed in dry,Room Temperature
form powder to crystal
color White to Almost white
InChIInChI=1S/C19H18F6/c1-11-5-7-15(9-13(11)3)17(18(20,21)22,19(23,24)25)16-8-6-12(2)14(4)10-16/h5-10H,1-4H3
InChIKeyGLFKFHJEFMLTOB-UHFFFAOYSA-N
SMILESC(C1=CC=C(C)C(C)=C1)(C1=CC=C(C)C(C)=C1)(C(F)(F)F)C(F)(F)F
CAS DataBase Reference65294-20-4(CAS DataBase Reference)
NIST Chemistry Reference2,2-Bis-(3,4-dimethylphenyl)-hexafluoropropane(65294-20-4)
EPA Substance Registry System2,2-Bis(3,4-dixylyl)hexafluoro propane (65294-20-4)
Safety Information
Hazard Codes Xi
Safety Statements 22-24/25
TSCA TSCA listed
HazardClass IRRITANT
HS Code 2903998090
MSDS Information
2,2-Bis(3,4-dimethylphenyl)hexafluoropropane Usage And Synthesis
Chemical Propertieswhite crystalline powder
Uses2,2-Bis(3,4-dimethylphenyl)hexafluoropropane can be used as a gas separation membrane due to its good separation performance and high plasticization resistance to carbon dioxide
Synthesis
o-Xylene

95-47-6

Hexafluoroacetone

684-16-2

2,2-Bis(3,4-dimethylphenyl)hexafluoropropane

65294-20-4

In a 2000 mL three-necked flask, 1000 g of tetrahydrofuran (THF), 424 g of o-xylene, and 60 g of p-toluenesulfonic acid (p-TsOH) were added, and the reaction temperature was controlled to be below 40°C. The reaction was carried out by a slow pass of 400 g of hexafluoroacetone gas. 400 g of hexafluoroacetone gas was slowly passed. After heating and refluxing the reaction for 12 hours, it was cooled to room temperature. The reaction mixture was washed with saturated sodium bicarbonate (NaHCO3) aqueous solution to pH 7-8. 500 g of toluene was added, partitioned and the organic phase was washed with deionized water. The washed organic phase was concentrated to give a solid crude product. The crude product was recrystallized by dissolving in 1200 g of ethanol. The wet product was dried under vacuum at 40 ℃ for 12 hours to obtain 670 g of white crystal product with 93.1% yield. The product was analyzed by gas chromatography (GC), and the purity was 99.6%, the content of single impurity was less than 0.1%, and the content of all metal ions was less than 1 ppm.

References[1] Patent: CN108395363, 2018, A. Location in patent: Paragraph 0052-0054
[2] Journal of Fluorine Chemistry, 2003, vol. 123, # 2, p. 221 - 225
2,2-Bis(3,4-dimethylphenyl)hexafluoropropane Preparation Products And Raw materials
Raw materials1,1,1,3,3,3-hexafluoropropane-2,2-diol-->Hexafluoropropylene oxide-->Hexafluoroacetone-->p-Toluenesulfonic acid monohydrate-->o-Xylene-->Tetrahydrofuran
Preparation Products4,4'-(Hexafluoroisopropylidene)diphthalic anhydride
Tag:2,2-Bis(3,4-dimethylphenyl)hexafluoropropane(65294-20-4) Related Product Information
Hexafluoropropylene oxide PERFLUOROPROPANE 1,1,1,2,2,3-HEXAFLUOROPROPANE 4,4'-(Hexafluoroisopropylidene)diphthalic anhydride 1,1,1,3,3,3-Hexafluoropropane 1,1-BIS(3,4-DIMETHYLPHENYL)ETHANE DI-P-TOLYLMETHANE 2,2-Bis(4-methylphenyl)hexafluoropropane 1,1,1,2,3,3,3-Heptafluoropropane 4,4'-(HEXAFLUOROISOPROPYLIDENE)DIPHTHALIC ACID 4-TERT-BUTYL-O-XYLENE hexafluoro-2,2-diphenylpropane 1,2-DIMETHYL-4-(1-PHENYL-ETHYL)-BENZENE 2,2-DI-P-TOLYLPROPANE 2,2-Bis(3,4-dimethylphenyl)hexafluoropropane fluoropropane