Molecular Formula: 258.12
Formula Weight: C9H4F6O2
Inchl Key: PINBPLCVZSKLTF-UHFFFAOYSA-N
Inchl: InChI=1S/C9H4F6O2/c10-8(11,12)4-1-2-6(9(13,14)15)5(3-4)7(16)17/h1-3H,(H,16,17)

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:	42580-42-7
Flash_Point:	N/A
Product_Name:	2,5-Bis(trifluoromethyl)benzoic acid
Bolling_Point:	55.2ºC at 760mmHg
FW:	258.11700
Melting_Point:	78-80 °C(lit.)
MF:	C9H4F6O2
Density:	1.319g/cm3

Refractive_Index:	1.424
LogP:	3.42240
Bolling_Point:	55.2ºC at 760mmHg
FW:	258.11700
PSA:	37.30000
Computational_Chemistry:	['1. XlogP :32 ', '2. Hydrogen Bond Donor Count :1 ', '3. Hydrogen Bond Acceptor Count :8 ', '4. Rotatable Bond Count :1 ', '5. Isotope Atom Count :N/A ', '6. TPSA 373 ', '7. Heavy Atom Count :17 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :295 ', '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:	78-80 °C(lit.)
MF:	C9H4F6O2
Exact_Mass:	258.01200
Density:	1.319g/cm3
More_Info:	['1 . Appearance Unknow ', '2 . Density（g/mL,25ºC）Unknow ', '3 . Relative vapor density（g/mL,Atmosphere =1） Unknow ', '4 . Melting point（ºC）78-80 ', '5 . Boiling point（ºC）Unknow ', '6 . Boiling point（ºC，19mm hg）Unknow ', '7 . Refractive indexUnknow ', '8 . Flash point（ºF）Unknow ', '9 . Specific rotation（ºC）Unknow ', '10 . Spontaneous ignition point or ignition temperature（ºC） Unknow ', '11 . Vapor pressure（kPa,20ºC）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']

Symbol:	GHS07
Risk_Statements(EU):	R36/37/38
HS_Code:	2916399090
WGK_Germany:	3
Personal_Protective_Equipment:	dust mask type N95 (US);Eyeshields;Gloves
RIDADR:	NONH for all modes of transport
Hazard_Codes:	Xi:Irritant;
Warning_Statement:	P261-P305 + P351 + P338
Safety_Statements:	H315-H319-H335