Product Name

  • Name

    ETHYL NONAFLUOROBUTYL ETHER

  • EINECS 425-340-0
  • CAS No. 163702-05-4
  • Density 1.441 g/cm3
  • Solubility
  • Melting Point - 138 °C(lit.)
  • Formula C6H5F9O
  • Boiling Point 67.8 °C at 760 mmHg
  • Molecular Weight 264.091
  • Flash Point 39 °F
  • Transport Information UN 1993 3
  • Appearance
  • Safety 16-23-45
  • Risk Codes 11-42
  • Molecular Structure Molecular Structure of 163702-05-4 (ETHYL NONAFLUOROBUTYL ETHER)
  • Hazard Symbols FlammableF; HarmfulXn; IrritantXi
  • Synonyms (Perfluorobutoxy)ethane;1-Ethoxy-1,1,2,2,3,3,4,4,4-nonafluorobutane;1-Ethoxynonafluorobutane;CF 76;Cosmetic Fluid CF 76;Ethyl nonafluorobutyl ether;Ethyl perfluorobutyl ether;HFE 569mccc;HFE 569sf2;HFE 7200;Nonafluorobutyl ethyl ether;Novec HFE 7200;1-ethoxy-1,1,2,2,3,3,4,4,4-nonafluorobutane;butane, 1-ethoxy-1,1,2,2,3,3,4,4,4-nonafluoro-;ethoxynonafluorobutane;Ethyl nonafluorobutyl ether;
  • PSA 9.23000
  • LogP 3.44860

Synthetic route

3-Iodophenol
626-02-8

3-Iodophenol

1-(Ethoxy)nonafluorobutane
163702-05-4

1-(Ethoxy)nonafluorobutane

C16H9F17O
1073480-22-4

C16H9F17O

Conditions
ConditionsYield
Stage #1: 1-(Ethoxy)nonafluorobutane With 9-borabicyclo[3.3.1]nonane dimer In 1,4-dioxane at 20 - 80℃; for 6h;
Stage #2: With sodium hydroxide; water In 1,4-dioxane at 20℃; for 0.5h;
Stage #3: 3-Iodophenol; (1,1'-bis(diphenylphosphino)ferrocene)palladium(II) dichloride In 1,4-dioxane for 48h;		78%
1-iodo-2,2,3,3,4,4,5,5,5-nonafluorobutane
423-39-2

1-iodo-2,2,3,3,4,4,5,5,5-nonafluorobutane

1,2-dibromo-4,5-dimethoxybenzene
37895-73-1

1,2-dibromo-4,5-dimethoxybenzene

1-(Ethoxy)nonafluorobutane
163702-05-4

1-(Ethoxy)nonafluorobutane

C16H8F18O2

C16H8F18O2

Conditions
ConditionsYield
With copper In dimethyl sulfoxide at 135℃;65%
...Expand
bis-2-hydroxy-5-bromophenylaldoxime nickel chelate

bis-2-hydroxy-5-bromophenylaldoxime nickel chelate

1-(Ethoxy)nonafluorobutane
163702-05-4

1-(Ethoxy)nonafluorobutane

bis-2-hydroxy-5-krytoxphenylaldoxime Ni chelate

bis-2-hydroxy-5-krytoxphenylaldoxime Ni chelate

Conditions
ConditionsYield
Stage #1: 1-(Ethoxy)nonafluorobutane With 9-bora-bicyclo[3.3.1]nonane In tetrahydrofuran at 0 - 20℃; for 24h;
Stage #2: bis-2-hydroxy-5-bromophenylaldoxime nickel chelate With sodium hydroxide; tetrakis(triphenylphosphine) palladium(0) In tetrahydrofuran; water for 24.5h; Heating / reflux;		53%
1-(Ethoxy)nonafluorobutane
163702-05-4

1-(Ethoxy)nonafluorobutane

C6H4F9O3

C6H4F9O3

Conditions
ConditionsYield
With hydroxide In chloroform at 21.85℃; Rate constant; Kinetics; Irradiation;
1-(Ethoxy)nonafluorobutane
163702-05-4

1-(Ethoxy)nonafluorobutane

ethyl perfluoroisobutyl ether

ethyl perfluoroisobutyl ether

A

C6H4ClF9O

C6H4ClF9O

B

C6H4ClF9O

C6H4ClF9O

C

C6H4ClF9O

C6H4ClF9O

D

C6H4ClF9O

C6H4ClF9O

E

C6H3Cl2F9O

C6H3Cl2F9O

F

C6H3Cl2F9O

C6H3Cl2F9O

G

C6H3Cl2F9O

C6H3Cl2F9O

H

C6H3Cl2F9O

C6H3Cl2F9O

I

C6H3Cl2F9O

C6H3Cl2F9O

J

C6H3Cl2F9O

C6H3Cl2F9O

Conditions
ConditionsYield
With chlorine Irradiation;
...Expand

Butane,1-ethoxy-1,1,2,2,3,3,4,4,4-nonafluoro- Specification

The Butane,1-ethoxy-1,1,2,2,3,3,4,4,4-nonafluoro-, with the CAS registry number 163702-05-4, has the systematic name of 1-ethoxy-1,1,2,2,3,3,4,4,4-nonafluorobutane. It belongs to the following product categories: Ethers; Organic Building Blocks; Oxygen Compounds. And the molecular formula of this chemical is C6H5F9O.

The physical properties of Butane,1-ethoxy-1,1,2,2,3,3,4,4,4-nonafluoro- are as following: (1)ACD/LogP: 5.20; (2)# of Rule of 5 Violations: 1; (3)#H bond acceptors: 1; (4)#H bond donors: 0; (5)#Freely Rotating Bonds: 4; (6)Polar Surface Area: 9.23 Å2; (7)Index of Refraction: 1.287; (8)Molar Refractivity: 32.92 cm3; (9)Molar Volume: 183.1 cm3; (10)Polarizability: 13.05×10-24cm3; (11)Surface Tension: 14.3 dyne/cm; (12)Density: 1.441 g/cm3; (13)Enthalpy of Vaporization: 29.67 kJ/mol; (14)Boiling Point: 67.8 °C at 760 mmHg; (15)Vapour Pressure: 156 mmHg at 25°C.

You should be cautious while dealing with this chemical. It is a kind of highly flammable chemical, and may cause sensitization by inhalation. Therefore, you had better take the following instructions: Keep away from sources of ignition - No smoking; Do not breathe gas/fumes/vapor/spray (appropriate wording to be specified by the manufacturer); In case of accident or if you feel unwell, seek medical advice immediately (show label where possible).

You can still convert the following datas into molecular structure:
(1)SMILES: FC(F)(C(F)(F)OCC)C(F)(F)C(F)(F)F
(2)InChI: InChI=1/C6H5F9O/c1-2-16-6(14,15)4(9,10)3(7,8)5(11,12)13/h2H2,1H3
(3)InChIKey: DFUYAWQUODQGFF-UHFFFAOYAO

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