Molecular Formula: 264.2
Formula Weight: C13H7F3N2O
Inchl Key: OOVASHBTYQTRFA-UHFFFAOYSA-N
Inchl: InChI=1S/C13H7F3N2O/c14-13(15,16)10-6-11(8-4-2-1-3-5-8)18-12(19)9(10)7-17/h1-6H,(H,18,19)

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

Product_Name:	2-oxo-6-phenyl-4-(trifluoromethyl)-1H-pyridine-3-carbonitrile
Flash_Point:	182.9ºC
Melting_Point:	>300 °C(lit.)
FW:	264.20300
Density:	1.41g/cm3
CAS:	3335-44-2
Bolling_Point:	378.7ºC at 760mmHg
MF:	C13H7F3N2O

Molecular_Structure:	['1 . Molar refractive index 6033 ', '2 . Molar volume （m3/mol）1868 ', '3 . Parachor （902K）4851 ', '4 . Surface tension 454 ', '5 . Dielectric constant （F/m）无可用 ', '6 偶极距（D）无可用 ', '7 . Polarizability （10 -24cm 3）2391']
Flash_Point:	182.9ºC
Refractive_Index:	1.559
FW:	264.20300
Density:	1.41g/cm3
Bolling_Point:	378.7ºC at 760mmHg
Computational_Chemistry:	['1. XlogP :22 ', '2. Hydrogen Bond Donor Count :1 ', '3. Hydrogen Bond Acceptor Count :5 ', '4. Rotatable Bond Count :1 ', '5. Isotope Atom Count :2 ', '6. TPSA 529 ', '7. Heavy Atom Count :19 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :502 ', '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']
LogP:	2.93238
Melting_Point:	>300 °C(lit.)
PSA:	56.65000
MF:	C13H7F3N2O
More_Info:	['1 . Appearance Unknow ', '2 . Density（g/mLat 25°C）Unknow ', '3 . Relative vapor density（g/mL,Atmosphere =1）Unknow ', '4 . Melting point（ºC）>300 ', '5 . Boiling point（ºC,Atmospheric pressure）Unknow ', '6 . Boiling point（ºC,16mmHg）Unknow ', '7 . Refractive index（n20/D）Unknow ', '8 . Flash point（ºC）Unknow ', '9 . Specific rotation（º）Unknow ', '10 . Spontaneous ignition point or ignition temperature（ºC）Unknow ', '11 . Vapor pressure（mmHg,37ºC）Unknow ', '12 . Saturated vapor pressure（kPa,1144 ºC）Unknow ', '13 . Combustion heat（KJ/mol）Unknow ', '14 . Critical temperature（ºC）Unknow ', '15 . Critical pressure（MPa）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']
Exact_Mass:	264.05100

Personal_Protective_Equipment:	Eyeshields;Gloves;type N95 (US);type P1 (EN143) respirator filter
Hazard_Codes:	Xi: Irritant;
Risk_Statements(EU):	R20/21/22
RIDADR:	NONH for all modes of transport
HS_Code:	2933399090
WGK_Germany:	3