2-(Trifluoromethyl)benzonitrile

Catalog No: FT-0608960

CAS No: 447-60-9

Molecular Formula: 171.12
Formula Weight: C8H4F3N
Inchl Key: SOZGHDCEWOLLHV-UHFFFAOYSA-N
Inchl: InChI=1S/C8H4F3N/c9-8(10,11)7-4-2-1-3-6(7)5-12/h1-4H

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

Symbol:	GHS07
CAS:	447-60-9
Flash_Point:	90.0±0.0 °C
Product_Name:	2-(Trifluoromethyl)benzonitrile
Bolling_Point:	205.0±35.0 °C at 760 mmHg
FW:	171.119
Melting_Point:	7.5 °C(lit.)
MF:	C8H4F3N
Density:	1.3±0.1 g/cm3

Refractive_Index:	1.461
Vapor_Pressure:	0.3±0.4 mmHg at 25°C
Flash_Point:	90.0±0.0 °C
LogP:	2.63
Bolling_Point:	205.0±35.0 °C at 760 mmHg
PSA:	23.79000
Molecular_Structure:	['1 . Molar refractive index 3631 ', '2 . Molar volume （m3/mol）1324 ', '3 . Parachor （902K）3150 ', '4 . Surface tension 320 5 . Polarizability （10 ', '-24cm ', '3）143']
Computational_Chemistry:	['1. XlogP :N/A ', '2. Hydrogen Bond Donor Count :0 ', '3. Hydrogen Bond Acceptor Count :4 ', '4. Rotatable Bond Count :0 ', '5. Isotope Atom Count :N/A ', '6. TPSA 238 ', '7. Heavy Atom Count :12 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :200 ', '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:	7.5 °C(lit.)
MF:	C8H4F3N
Exact_Mass:	171.029587
FW:	171.119
Density:	1.3±0.1 g/cm3
More_Info:	['1 . Appearance Colourless or 淡Yellow Liquid ', '2 . Density（g/mL,25/4℃）1294 ', '3 . Relative vapor density（g/mL,Atmosphere =1）59 ', '4 . Melting point（ºC）75 ', '5 . Boiling point（ºC,Atmospheric pressure）88-89 ', '6 . Boiling point（ºC,52kPa）Unknow ', '7 . Refractive index14632 ', '8 . Flash point（ºF）194 ', '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 难Soluble in Water ']

Symbol:	GHS07
RIDADR:	UN 3276 6.1/PG 3
HS_Code:	2926909090
Packing_Group:	III
Hazard_Class:	6.1
Risk_Statements(EU):	R22
WGK_Germany:	2
Personal_Protective_Equipment:	Eyeshields;Faceshields;full-face respirator (US);Gloves;multi-purpose combination respirator cartridge (US);type ABEK (EN14387) respirator filter
Hazard_Codes:	Xn: Harmful;
Safety_Statements:	H302