CAS No.163702-05-4,ETHYL NONAFLUOROBUTYL ETHER Suppliers,MSDS download

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Basic Information

Molecular Structure:
CAS No.:	163702-05-4
Name:	ETHYL NONAFLUOROBUTYL ETHER

Formula:	C₆H₅F₉O
Molecular Weight:	264.091
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;
EINECS:	425-340-0
Density:	1.441 g/cm³
Melting Point:	- 138 °C(lit.)
Boiling Point:	67.8 °C at 760 mmHg
Flash Point:	39 °F
Hazard Symbols:	F; Xn; Xi
Risk Codes:	11-42
Safety:	16-23-45
Transport Information:	UN 1993 3
PSA:	9.23000
LogP:	3.44860

Synthetic route

: 626-02-8
3-Iodophenol

: 163702-05-4
1-(Ethoxy)nonafluorobutane

: 1073480-22-4
C16H9F17O

Conditions

Conditions	Yield
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%

: 423-39-2
1-iodo-2,2,3,3,4,4,5,5,5-nonafluorobutane

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

: 163702-05-4
1-(Ethoxy)nonafluorobutane

: C16H8F18O2

Conditions

Conditions	Yield
With copper In dimethyl sulfoxide at 135℃;	65%

...Expand

: bis-2-hydroxy-5-bromophenylaldoxime nickel chelate

: 163702-05-4
1-(Ethoxy)nonafluorobutane

bis-2-hydroxy-5-krytoxphenylaldoxime Ni chelate: bis-2-hydroxy-5-krytoxphenylaldoxime Ni chelate

Conditions

Conditions	Yield
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%

: 163702-05-4
1-(Ethoxy)nonafluorobutane

: C6H4F9O3

Conditions

Conditions	Yield
With hydroxide In chloroform at 21.85℃; Rate constant; Kinetics; Irradiation;

: 163702-05-4
1-(Ethoxy)nonafluorobutane

: ethyl perfluoroisobutyl ether

A: C6H4ClF9O

B: C6H4ClF9O

C: C6H4ClF9O

D: C6H4ClF9O

E: C6H3Cl2F9O

F: C6H3Cl2F9O

G: C6H3Cl2F9O

H: C6H3Cl2F9O

I: C6H3Cl2F9O

J: C6H3Cl2F9O

Conditions

Conditions	Yield
With chlorine Irradiation;

...Expand

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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