FT-0616961 CAS:16063-80-2 chemical structure

HEXAFLUORO-DL-VALINE

Name: HEXAFLUORO-DL-VALINE
Rating: 4.5 (11 reviews)

Catalog No: FT-0616961

CAS No: 16063-80-2

Molecular Formula: 225.09
Formula Weight: C5H5F6NO2
Inchl Key: KRNSHCKTGFAMPQ-UHFFFAOYSA-N
Inchl: InChI=1S/C5H5F6NO2/c6-4(7,8)2(5(9,10)11)1(12)3(13)14/h1-2H,12H2,(H,13,14)

Assay	Pack	Price	Stock
98%	1g	N/A	N/A
98%	5g	N/A	N/A
98%	Bulk Quantity	N/A	N/A

Melting_Point:	204°C (dec.)
CAS:	16063-80-2
MF:	C5H5F6NO2
Flash_Point:	54.1ºC
Product_Name:	hexafluoro-dl-valine
Density:	1.575 g/cm3
FW:	225.08900
Bolling_Point:	165.9ºC at 760 mmHg

Refractive_Index:	1.349
Flash_Point:	54.1ºC
LogP:	1.83940
Bolling_Point:	165.9ºC at 760 mmHg
FW:	225.08900
PSA:	63.32000
Computational_Chemistry:	['1. XlogP :-09 ', '2. Hydrogen Bond Donor Count :2 ', '3. Hydrogen Bond Acceptor Count :9 ', '4. Rotatable Bond Count :2 ', '5. Isotope Atom Count :N/A ', '6. TPSA 633 ', '7. Heavy Atom Count :14 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :207 ', '10. Isotope Atom Count :0 ', '11. Defined Atom Stereocenter Count :0 ', '12. Undefined Atom Stereocenter Count :1 ', '13. Defined Bond Stereocenter Count :0 ', '14. Undefined Bond Stereocenter Count :0 ', '15. Covalently-Bonded Unit Count :1']
Melting_Point:	204°C (dec.)
MF:	C5H5F6NO2
Exact_Mass:	225.02200
Molecular_Structure:	['分子性质数据 ', '1 . Molar refractive index 3114 ', '2 . Molar volume （m3/mol）1429 ', '3 . Parachor （902K）3239 ', '4 . Surface tension 263 ', '5 . Polarizability （10 -24cm 3）1234']
Density:	1.575 g/cm3
More_Info:	['1. Appearance Unknow ', '2. Density（g/mL,25/4℃）Unknow ', '3. Relative vapor density（g/mL,Atmosphere =1）Unknow ', '4. Melting point（ºC ):204 ', '5. Boiling point（ºC,Atmospheric pressure）Unknow ', '6. Boiling point（ºC,52kPa）Unknow ', '7. Refractive indexUnknow ', '8. Flash point（ºC）Unknow ', '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']