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Ethane,1-ethoxy-1,1,2,2-tetrafluoro- (512-51-6)

Identification
Name:Ethane,1-ethoxy-1,1,2,2-tetrafluoro-
Synonyms:Ether,ethyl 1,1,2,2-tetrafluoroethyl (6CI,7CI,8CI);1,1,2,2-Tetrafluoroethyl ethylether;1-Ethoxy-1,1,2,2-tetrafluoroethane;374pcEbg;Ethyl 1,1,2,2-tetrafluoroethylether;
CAS:512-51-6
Molecular Formula: C4H6F4O
Molecular Weight: 146.08
InChI: InChI=1/C4H6F4O/c1-2-9-4(7,8)3(5)6/h3H,2H2,1H3
Molecular Structure: (C4H6F4O) Ether,ethyl 1,1,2,2-tetrafluoroethyl (6CI,7CI,8CI);1,1,2,2-Tetrafluoroethyl ethylether;1-Ethoxy-1,1,...
Properties
Transport:3271
Flash Point: °C
Density:1.19
Refractive index:1.294
Specification:

The Ethyl 1,1,2,2-tetrafluoroethyl ether with cas registry number of 512-51-6, has the systematic name of 1-ethoxy-1,1,2,2-tetrafluoroethane. And its IUPAC name is also 1-ethoxy-1,1,2,2-tetrafluoroethane.

Physical properties about this chemical are: (1)ACD/LogP: 1.44; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.44; (4)ACD/LogD (pH 7.4): 1.44; (5)ACD/BCF (pH 5.5): 7.3; (6)ACD/BCF (pH 7.4): 7.3; (7)ACD/KOC (pH 5.5): 144.45; (8)ACD/KOC (pH 7.4): 144.45; (9)#H bond acceptors: 1; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 3; (12)Polar Surface Area: 9.23 Å2; (13)Index of Refraction: 1.298; (14)Molar Refractivity: 22.9 cm3; (15)Molar Volume: 123.1 cm3; (16)Polarizability: 9.08×10-24cm3; (17)Surface Tension: 14.7 dyne/cm; (18)Enthalpy of Vaporization: 27.62 kJ/mol; (19)Vapour Pressure: 381 mmHg at 25°C.

When you are using this chemical, please be cautious about it as the following:
The Ethyl 1,1,2,2-tetrafluoroethyl ether is highly flammable. So keep it away from sources of ignition.When use it, take precautionary measures against static discharges and do not breathe vapour.

You can still convert the following datas into molecular structure:
(1)SMILES: FC(F)C(F)(F)OCC;
(2)InChI: InChI=1/C4H6F4O/c1-2-9-4(7,8)3(5)6/h3H,2H2,1H3;
(3)InChIKey: HBRLMDFVVMYNFH-UHFFFAOYAA;
(4)Std. InChI: InChI=1S/C4H6F4O/c1-2-9-4(7,8)3(5)6/h3H,2H2,1H3;
(5)Std. InChIKey: HBRLMDFVVMYNFH-UHFFFAOYSA-N

The toxicity data is as follows:

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rat LC inhalation > 30000ppm/4H (30000ppm) BEHAVIORAL: GENERAL ANESTHETIC

BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY)

LUNGS, THORAX, OR RESPIRATION: DYSPNEA
National Technical Information Service. Vol. OTS0557969,

Packinggroup: II
Flash Point: °C
Safety Data