FT-0608245 CAS:321-07-3 chemical structure

1-PHENYL-3-(TRIFLUOROMETHYL)-2-PYRAZOLIN-5-ONE

Name: 1-PHENYL-3-(TRIFLUOROMETHYL)-2-PYRAZOLIN-5-ONE
Rating: 4.5 (11 reviews)

Catalog No: FT-0608245

CAS No: 321-07-3

Molecular Formula: 228.17
Formula Weight: C10H7F3N2O
Inchl Key: GLGRRRKQSFURGD-UHFFFAOYSA-N
Inchl: InChI=1S/C10H7F3N2O/c11-10(12,13)8-6-9(16)15(14-8)7-4-2-1-3-5-7/h1-5H,6H2

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:	195-196°C
CAS:	321-07-3
MF:	C10H7F3N2O
Flash_Point:	122.3ºC
Product_Name:	2-phenyl-5-(trifluoromethyl)-4H-pyrazol-3-one
Density:	1.39g/cm3
FW:	228.17100
Bolling_Point:	278.7ºC at 760mmHg

Refractive_Index:	1.543
Flash_Point:	122.3ºC
LogP:	1.84220
Bolling_Point:	278.7ºC at 760mmHg
FW:	228.17100
PSA:	32.67000
Computational_Chemistry:	['1. XlogP :24 ', '2. Hydrogen Bond Donor Count :0 ', '3. Hydrogen Bond Acceptor Count :5 ', '4. Rotatable Bond Count :1 ', '5. Isotope Atom Count :3 ', '6. TPSA 327 ', '7. Heavy Atom Count :16 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :319 ', '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']
Melting_Point:	195-196°C
MF:	C10H7F3N2O
Exact_Mass:	228.05100
Molecular_Structure:	['1 . Molar refractive index 5153 ', '2 . Molar volume （m3/mol）1634 ', '3 . Parachor （902K）4058 ', '4 . Surface tension 379 ', '5 . Polarizability （10 -24cm 3）2043']
Density:	1.39g/cm3
More_Info:	['一物性数据 ', '. Appearance 不可用 ', '. Density（g/mL,25/4℃）不可用 ', '. Relative vapor density（g/mL,Atmosphere =1）不可用 ', '. Melting point（ºC）195-196 ', '. Boiling point（ºC,Atmospheric pressure）不可用 ', '. Boiling point（ºC,52kPa）不可用 ', '. Refractive index不可用 ', '. Flash point（ºC）不可用 ', '. Specific rotation（º）不可用 ', '. Spontaneous ignition point or ignition temperature（ºC）不可用 ', '. Vapor pressure（kPa,25ºC）不可用 ', '. Saturated vapor pressure（kPa,60ºC）不可用 ', '. Combustion heat（KJ/mol）不可用 ', '. Critical temperature（ºC）不可用 ', '. Critical pressure（KPa）不可用 ', '. Oil-water（Octanol /Water ）Logarithmic Value of Distribution Coefficient 不可用 ', '. Upper limit of explosion（%,V/V）不可用 ', '. Lower limit of explosion（%,V/V）不可用 ', '. Solubility 不可用']