2-Methyl-5-trifluoromethylbenzoic acid

Name: 2-Methyl-5-trifluoromethylbenzoic acid
Rating: 4.5 (11 reviews)

Catalog No: FT-0651157

CAS No: 13055-63-5

Molecular Formula: 204.15
Formula Weight: C9H7F3O2
Inchl Key: STJUSBSLJXOSDU-UHFFFAOYSA-N
Inchl: InChI=1S/C9H7F3O2/c1-5-2-3-6(9(10,11)12)4-7(5)8(13)14/h2-4H,1H3,(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:	123-125°C
CAS:	13055-63-5
MF:	C9H7F3O2
Flash_Point:	111.7±27.3 °C
Product_Name:	2-Methyl-5-(trifluoromethyl)benzoic acid
Density:	1.3±0.1 g/cm3
FW:	204.146
Bolling_Point:	261.0±40.0 °C at 760 mmHg

Refractive_Index:	1.478
Vapor_Pressure:	0.0±0.6 mmHg at 25°C
Flash_Point:	111.7±27.3 °C
LogP:	3.41
Bolling_Point:	261.0±40.0 °C at 760 mmHg
PSA:	37.30000
Molecular_Structure:	['1 . Molar refractive index 4298 ', '2 . Molar volume （m3/mol）1517 ', '3 . Parachor （902K）3642 ', '4 . Surface tension 331 ', '5 . Polarizability 1704']
Computational_Chemistry:	['1. XlogP :27 ', '2. Hydrogen Bond Donor Count :1 ', '3. Hydrogen Bond Acceptor Count :5 ', '4. Rotatable Bond Count :1 ', '5. Isotope Atom Count :N/A ', '6. TPSA 373 ', '7. Heavy Atom Count :14 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :225 ', '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:	123-125°C
MF:	C9H7F3O2
Exact_Mass:	204.039810
FW:	204.146
Density:	1.3±0.1 g/cm3
More_Info:	['1 . Appearance Unknow。 ', '2 . Density（g/mL, 25 ℃ ）Unknow ', '3 . Relative vapor density（g/mL,Atmosphere =1）Unknow ', '4 . Melting point（ºC）123-125 ', '5 . Boiling point（ºC,Atmospheric pressure）Unknow ', '6 . Boiling point（ºC，01mmHg）Unknow ', '7 . Refractive indexUnknow ', '8 . Flash point（ºF）Unknow ', '9 . Specific rotation（º）Unknow ', '10 . Spontaneous ignition point or ignition temperature（ºC）Unknow ', '11 . Vapor pressure（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']