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Name |
1-Propanol,2,3,3,3-tetrafluoro-2-[1,1,2,3,3,3-hexafluoro-2-(1,1,2,2,3,3,3-heptafluoropropoxy)propoxy]- |
EINECS | N/A |
CAS No. | 14548-74-4 | Density | 1.719 g/cm3 |
PSA | 38.69000 | LogP | 4.85130 |
Solubility | N/A | Melting Point |
N/A |
Formula | C9H3F17O3 | Boiling Point | 251.9 °C at 760 mmHg |
Molecular Weight | 482.094 | Flash Point | 123 °C |
Transport Information | N/A | Appearance | N/A |
Safety | Risk Codes |
Xi:Irritant; |
|
Molecular Structure | Hazard Symbols | Xi | |
Synonyms |
1H,1H-Perfluoro-2,5-dimethyl-3,6-dioxanonan-1-ol;2,3,3,3-Tetrafluoro-2-(1,1,2,3,3,3-hexafluoro-2-(1,1,2,2,3,3,3-fluoropropoxy)propoxy)-1-propanol;1-Propanol,2,3,3,3-tetrafluoro-2-[1,1,2,3,3,3-hexafluoro-2-(heptafluoropropoxy)propoxy]-(9CI);1-Propanol,2,3,3,3-tetrafluoro-2-[hexafluoro-2-(heptafluoropropoxy)propoxy]- (8CI);1H,1H-2,5-Di(trifluoromethyl)-3,6-dioxaundecafluorononanol; |
Article Data | 6 |
perfluoro-2,5-dimethyl-3,6-dioxanonanoyl fluoride
2,3,3,3-tetrafluoro-2-[1,1,2,3,3,3-hexafluoro-2-(heptafluoropropoxy)propoxy]-1-propanol
Conditions | Yield |
---|---|
With lithium aluminium tetrahydride In diethyl ether at 20℃; for 2h; Inert atmosphere; Reflux; | 90% |
Multi-step reaction with 2 steps 1: 86.3 percent / Na2CO3; MgSO4; silica gel / diethyl ether / 20 °C 2: 81.1 percent / NaBH4 / diethyl ether; methanol / 12 h / Heating View Scheme |
methyl 2,4,4,5,7,7,8,8,9,9,9-undecafluoro-2,5-bis(trifluoromethyl)-3,6-dioxanonanoate
2,3,3,3-tetrafluoro-2-[1,1,2,3,3,3-hexafluoro-2-(heptafluoropropoxy)propoxy]-1-propanol
Conditions | Yield |
---|---|
With sodium tetrahydroborate In methanol; diethyl ether for 12h; Heating; | 81.1% |
With sodium tetrahydroborate In methanol; diethyl ether for 11h; Reflux; Inert atmosphere; | 75% |
With sodium tetrahydroborate; isopropyl alcohol | |
With sodium tetrahydroborate In methanol at 20℃; for 2h; Cooling with ice; |
2,4,4,5,7,7,8,8,9,9,9-undecafluoro-2,5-bis(trifluoromethyl)-3,6-dioxanonyl trifluoromethanesulfonate
2,3,3,3-tetrafluoro-2-[1,1,2,3,3,3-hexafluoro-2-(heptafluoropropoxy)propoxy]-1-propanol
Conditions | Yield |
---|---|
With sodium hydride; phenol In dimethyl sulfoxide at 130℃; Inert atmosphere; |
2,3,4,5,6-pentafluorostyrene
2,3,3,3-tetrafluoro-2-[1,1,2,3,3,3-hexafluoro-2-(heptafluoropropoxy)propoxy]-1-propanol
Conditions | Yield |
---|---|
Stage #1: 2,3,3,3-tetrafluoro-2-[1,1,2,3,3,3-hexafluoro-2-(heptafluoropropoxy)propoxy]propan-1-ol With sodium hydride In tetrahydrofuran at 20℃; Inert atmosphere; Stage #2: 2,3,4,5,6-pentafluorostyrene In tetrahydrofuran at 0℃; Reflux; Inert atmosphere; | 90% |
2,3,3,3-tetrafluoro-2-[1,1,2,3,3,3-hexafluoro-2-(heptafluoropropoxy)propoxy]-1-propanol
2-(trifluoromethyl)acrylic chloride
Conditions | Yield |
---|---|
Stage #1: 2,3,3,3-tetrafluoro-2-[1,1,2,3,3,3-hexafluoro-2-(heptafluoropropoxy)propoxy]propan-1-ol With pyridine at -10℃; for 0.333333h; Inert atmosphere; Stage #2: 2-(trifluoromethyl)acrylic chloride at -10 - 20℃; for 17h; Inert atmosphere; | 85% |
2,3,3,3-tetrafluoro-2-[1,1,2,3,3,3-hexafluoro-2-(heptafluoropropoxy)propoxy]-1-propanol
Methacryloyl chloride
Conditions | Yield |
---|---|
With 2,2-diphenyl-1-picrylhydrazyl; triethylamine In diethyl ether at 20℃; for 4h; | 82% |
3-Bromopropionic acid
2,3,3,3-tetrafluoro-2-[1,1,2,3,3,3-hexafluoro-2-(heptafluoropropoxy)propoxy]-1-propanol
C12H6BrF17O4
Conditions | Yield |
---|---|
With trifluoroacetic anhydride at 20 - 30℃; for 4.5h; | 80% |
2,3,3,3-tetrafluoro-2-[1,1,2,3,3,3-hexafluoro-2-(heptafluoropropoxy)propoxy]-1-propanol
1-Adamantanecarbonyl chloride
C20H17F17O4
Conditions | Yield |
---|---|
With pyridine at 20 - 50℃; for 5h; | 74.4% |
With pyridine at 25 - 50℃; for 5h; | 74.4 %Spectr. |
trifluoromethylsulfonic anhydride
2,3,3,3-tetrafluoro-2-[1,1,2,3,3,3-hexafluoro-2-(heptafluoropropoxy)propoxy]-1-propanol
2,4,4,5,7,7,8,8,9,9,9-undecafluoro-2,5-bis(trifluoromethyl)-3,6-dioxanonyl trifluoromethanesulfonate
Conditions | Yield |
---|---|
With pyridine In dichloromethane at 0 - 20℃; Inert atmosphere; | 70.2% |
With pyridine In dichloromethane Inert atmosphere; | 70% |
2,3,3,3-tetrafluoro-2-[1,1,2,3,3,3-hexafluoro-2-(heptafluoropropoxy)propoxy]-1-propanol
C9H2Cl2F17O4P
Conditions | Yield |
---|---|
With lithium chloride; trichlorophosphate | 63% |
The 1-Propanol,2,3,3,3-tetrafluoro-2-[1,1,2,3,3,3-hexafluoro-2-(1,1,2,2,3,3,3-heptafluoropropoxy)propoxy]-, with the CAS registry number 14548-74-4, is also known as 1H,1H-2,5-Di(trifluoromethyl)-3,6-dioxaundecafluorononanol. This chemical's molecular formula is C9H3F17O3 and molecular weight is 482.09. What's more, its systematic name is 2,3,3,3-tetrafluoro-2-[1,1,2,3,3,3-hexafluoro-2-(heptafluoropropoxy)propoxy]propan-1-ol.
Physical properties of 1-Propanol,2,3,3,3-tetrafluoro-2-[1,1,2,3,3,3-hexafluoro-2-(1,1,2,2,3,3,3-heptafluoropropoxy)propoxy]- are: (1)ACD/LogP: 11.66; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): 11.66; (4)ACD/LogD (pH 7.4): 11.66; (5)ACD/BCF (pH 5.5): 1000000; (6)ACD/BCF (pH 7.4): 1000000; (7)ACD/KOC (pH 5.5): 10000000; (8)ACD/KOC (pH 7.4): 10000000; (9)#H bond acceptors: 3; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 8; (12)Polar Surface Area: 27.69 Å2; (13)Index of Refraction: 1.292; (14)Molar Refractivity: 51.27 cm3; (15)Molar Volume: 280.3 cm3; (16)Polarizability: 20.32×10-24cm3; (17)Surface Tension: 16.9 dyne/cm; (18)Density: 1.719 g/cm3; (19)Flash Point: 123 °C; (20)Enthalpy of Vaporization: 56.83 kJ/mol; (21)Boiling Point: 251.9 °C at 760 mmHg; (22)Vapour Pressure: 0.00313 mmHg at 25°C.
Uses of 1-Propanol,2,3,3,3-tetrafluoro-2-[1,1,2,3,3,3-hexafluoro-2-(1,1,2,2,3,3,3-heptafluoropropoxy)propoxy]-: it can be used to produce [2,3,3,3-tetrafluoro-2-(hexafluoro-heptafluoropropyloxy-propoxy)-propoxy]-ethene at the temperature of 0 - 10 °C. It will need reagents mercuric acetate, conc. H2SO4 with the reaction time of 8 hours. The yield is about 30%.
You can still convert the following datas into molecular structure:
(1)SMILES: FC(F)(C(F)(F)OC(F)(C(F)(F)OC(F)(C(F)(F)F)CO)C(F)(F)F)C(F)(F)F
(2)InChI: InChI=1S/C9H3F17O3/c10-2(1-27,5(14,15)16)28-9(25,26)4(13,7(20,21)22)29-8(23,24)3(11,12)6(17,18)19/h27H,1H2
(3)InChIKey: URIUSGOUQUQAMG-UHFFFAOYSA-N