ETHYL 4,4,4-TRIFLUORO-3-(TRIFLUOROMETHYL)CROTONATE

Catalog No: FT-0626052

CAS No: 1513-60-6

Chemical Name: ETHYL 4,4,4-TRIFLUORO-3-(TRIFLUOROMETHYL)CROTONATE
Molecular Formula: C7H6F6O2
Molecular Weight: 236.11
InChI Key: CULZFNOUPBWSIZ-UHFFFAOYSA-N
InChI: InChI=1S/C7H6F6O2/c1-2-15-5(14)3-4(6(8,9)10)7(11,12)13/h3H,2H2,1H3

Product pricing and availability information
Assay	Pack Size	Price	Stock
98%	1g	N/A	N/A
98%	5g	N/A	N/A
98%	Bulk Quantity	N/A	N/A

Melting_Point:	N/A
CAS:	1513-60-6
MF:	C7H6F6O2
Flash_Point:	43°C
Product_Name:	ethyl 4,4,4-trifluoro-3-(trifluoromethyl)but-2-enoate
Density:	>1.1
FW:	236.11200
Bolling_Point:	128 °C

Refractive_Index:	1.341
Vapor_Pressure:	5.69mmHg at 25°C
Flash_Point:	43°C
LogP:	2.60050
Bolling_Point:	128 °C
FW:	236.11200
PSA:	26.30000
Computational_Chemistry:	['1. XlogP :3 ', '2. Hydrogen Bond Donor Count :0 ', '3. Hydrogen Bond Acceptor Count :8 ', '4. Rotatable Bond Count :3 ', '5. Isotope Atom Count :N/A ', '6. TPSA 263 ', '7. Heavy Atom Count :15 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :246 ', '10. Isotope Atom Count :0 ', '11. Defined Atom Stereocenter Count :0 ', '12. Undefined Atom Stereocenter Count :0 ', '13. Defined Bond Stereocenter Count :0 ', '14. Undefined Bond Stereocenter Count :0 ', '15. Covalently-Bonded Unit Count :1']
MF:	C7H6F6O2
Exact_Mass:	236.02700
Molecular_Structure:	['1 . Molar refractive index 3706 ', '2 . Molar volume （m3/mol）1737 ', '3 . Parachor （902K）3660 ', '4 . Surface tension : 196 ', '5 . Dielectric constant 无可用 ', '6 偶极距（10 -24cm 3）无可用 ', '7 . Polarizability 1469']
Density:	>1.1
More_Info:	['1 . Appearance Unknow。 ', '2 . Density（g/mL,25/4℃） >11 ', '3 . Relative vapor density（g/mL,Atmosphere =1）Unknow ', '4 . Melting point（ºC）Unknow ', '5 . Boiling point（ºC,Atmospheric pressure）128 ', '6 . Boiling point（ºC,52kPa） Unknow ', '7 . Refractive index 1341 ', '8 . Flash point（ºC） 43 ', '9 . Specific rotation（º） Unknow ', '10 . Spontaneous ignition point or ignition temperature（ºC） Unknow ', '11 . Vapor pressure（kPa,25ºC） Unknow ', '12 . Saturated vapor pressure（kPa,60ºC） Unknow ', '13 . Combustion heat（KJ/mol）Unknow ', '14 . Critical temperature（ºC） Unknow ', '15 . Critical pressure（KPa） Unknow ', '16 . Oil-water（Octanol /Water ）Logarithmic Value of Distribution Coefficient Unknow ', '17 . Upper limit of explosion（%,V/V）Unknow ', '18 . Lower limit of explosion（%,V/V） Unknow ', '19 . Solubility Unknow']