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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]-

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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 Molecular Structure of 14548-74-4 (1H,1H-2,5-DI(TRIFLUOROMETHYL)-3,6-DIOXAUNDECAFLUORONONANOL) Hazard Symbols IrritantXi
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

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]- Synthetic route

2641-34-1

perfluoro-2,5-dimethyl-3,6-dioxanonanoyl fluoride

14548-74-4

2,3,3,3-tetrafluoro-2-[1,1,2,3,3,3-hexafluoro-2-(heptafluoropropoxy)propoxy]-1-propanol

Conditions
ConditionsYield
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
26131-32-8

methyl 2,4,4,5,7,7,8,8,9,9,9-undecafluoro-2,5-bis(trifluoromethyl)-3,6-dioxanonanoate

14548-74-4

2,3,3,3-tetrafluoro-2-[1,1,2,3,3,3-hexafluoro-2-(heptafluoropropoxy)propoxy]-1-propanol

Conditions
ConditionsYield
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;
1173110-39-8

2,4,4,5,7,7,8,8,9,9,9-undecafluoro-2,5-bis(trifluoromethyl)-3,6-dioxanonyl trifluoromethanesulfonate

14548-74-4

2,3,3,3-tetrafluoro-2-[1,1,2,3,3,3-hexafluoro-2-(heptafluoropropoxy)propoxy]-1-propanol

Conditions
ConditionsYield
With sodium hydride; phenol In dimethyl sulfoxide at 130℃; Inert atmosphere;
653-34-9

2,3,4,5,6-pentafluorostyrene

14548-74-4

2,3,3,3-tetrafluoro-2-[1,1,2,3,3,3-hexafluoro-2-(heptafluoropropoxy)propoxy]-1-propanol

C17H5F21O3

Conditions
ConditionsYield
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%
14548-74-4

2,3,3,3-tetrafluoro-2-[1,1,2,3,3,3-hexafluoro-2-(heptafluoropropoxy)propoxy]-1-propanol

90715-73-4

2-(trifluoromethyl)acrylic chloride

2,3,3,3-tetrafluoro-2-[1,1,2,3,3,3-hexafluoro-2-(perfluoropropoxy)propoxy]propyl 2-(trifluoromethyl)acrylate

Conditions
ConditionsYield
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%
14548-74-4

2,3,3,3-tetrafluoro-2-[1,1,2,3,3,3-hexafluoro-2-(heptafluoropropoxy)propoxy]-1-propanol

920-46-7

Methacryloyl chloride

2,4,4,5,7,7,8,8,9,9,9-undecafluoro-2,5-bis(trifluoromethyl)-3,6-dioxanonyl methacrylate

Conditions
ConditionsYield
With 2,2-diphenyl-1-picrylhydrazyl; triethylamine In diethyl ether at 20℃; for 4h;82%
590-92-1

3-Bromopropionic acid

14548-74-4

2,3,3,3-tetrafluoro-2-[1,1,2,3,3,3-hexafluoro-2-(heptafluoropropoxy)propoxy]-1-propanol

820958-27-8

C12H6BrF17O4

Conditions
ConditionsYield
With trifluoroacetic anhydride at 20 - 30℃; for 4.5h;80%
14548-74-4

2,3,3,3-tetrafluoro-2-[1,1,2,3,3,3-hexafluoro-2-(heptafluoropropoxy)propoxy]-1-propanol

2094-72-6

1-Adamantanecarbonyl chloride

709615-35-0

C20H17F17O4

Conditions
ConditionsYield
With pyridine at 20 - 50℃; for 5h;74.4%
With pyridine at 25 - 50℃; for 5h;74.4 %Spectr.
358-23-6

trifluoromethylsulfonic anhydride

14548-74-4

2,3,3,3-tetrafluoro-2-[1,1,2,3,3,3-hexafluoro-2-(heptafluoropropoxy)propoxy]-1-propanol

1173110-39-8

2,4,4,5,7,7,8,8,9,9,9-undecafluoro-2,5-bis(trifluoromethyl)-3,6-dioxanonyl trifluoromethanesulfonate

Conditions
ConditionsYield
With pyridine In dichloromethane at 0 - 20℃; Inert atmosphere;70.2%
With pyridine In dichloromethane Inert atmosphere;70%
14548-74-4

2,3,3,3-tetrafluoro-2-[1,1,2,3,3,3-hexafluoro-2-(heptafluoropropoxy)propoxy]-1-propanol

1429405-66-2

C9H2Cl2F17O4P

Conditions
ConditionsYield
With lithium chloride; trichlorophosphate63%

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]- Specification

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%.

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]- can be used to produce [2,3,3,3-tetrafluoro-2-(hexafluoro-heptafluoropropyloxy-propoxy)-propoxy]-ethene at the temperature of 0 - 10 °C

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

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