3-(Trifluoromethyl)benzoic acid
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Product Description
Product
3-(Trifluoromethyl)benzoic acid
CAS
454-92-2
Formula
C8H5F3O2
Synonym
3-(Trifluoromethyl)benzoic acid; a,a,a-Trifluoro-m-toluic acid; alpha,alpha,alpha-Trifluoro-m-toluic acid; Benzoic acid, 3-(trifluoromethyl)-; Benzoic acid, 3-(trifluoromethyl)- (9CI); Benzoic acid, trifluoromethyl-; EINECS 207-230-2; MTF-BOA; m-Toluic acid, a,a,a-trifluoro-; m-Toluic acid, alpha,alpha,alpha-trifluoro-; m-Toluic acid, alpha,alpha,alpha-trifluoro- (8CI); m-Trifluoromethylbenzoic acid; m-Trifluorometylbenzoic acid; NSC 43025; TIMTEC-BB SBB003661; UNII-930H336M90; ,,-Trifluoro-m-toluicacid
Typical Product Specifications
Molecular weight
190.12
EINECS
207-230-2
SMILES
c1(cc(ccc1)C(O)=O)C(F)(F)F
InChI
1S/C8H5F3O2/c9-8(10,11)6-3-1-2-5(4-6)7(12)13/h1-4H,(H,12,13)
InChIKey
FQXQBFUUVCDIRK-UHFFFAOYSA-N
Vapor Pressure
9.87E-03 mm Hg
Boiling Point
238.5 ° C
log P (octanol-water)
2.95
Henry's Law Constant
9.42E-07 atm-m3/mole
Atmospheric OH Rate Constant
6.65E-13 cm3/molecule-sec
Water solubility
149 mg/L
Melting Point
105.5 ° C
Boiling Point
238.5 °C775 mm Hg
BRN Number
2049239
Flash Point
237-240°C
Melting Point
104-106 °C
Class
3-(Trifluoromethyl)benzoic acid
Product Description
Product
3-(Trifluoromethyl)benzoic acid
CAS
454-92-2
Formula
C8H5F3O2
Synonym
3-(Trifluoromethyl)benzoic acid; a,a,a-Trifluoro-m-toluic acid; alpha,alpha,alpha-Trifluoro-m-toluic acid; Benzoic acid, 3-(trifluoromethyl)-; Benzoic acid, 3-(trifluoromethyl)- (9CI); Benzoic acid, trifluoromethyl-; EINECS 207-230-2; MTF-BOA; m-Toluic acid, a,a,a-trifluoro-; m-Toluic acid, alpha,alpha,alpha-trifluoro-; m-Toluic acid, alpha,alpha,alpha-trifluoro- (8CI); m-Trifluoromethylbenzoic acid; m-Trifluorometylbenzoic acid; NSC 43025; TIMTEC-BB SBB003661; UNII-930H336M90; ,,-Trifluoro-m-toluicacid
Typical Product Specifications
Molecular weight
190.12
EINECS
207-230-2
SMILES
c1(cc(ccc1)C(O)=O)C(F)(F)F
InChI
1S/C8H5F3O2/c9-8(10,11)6-3-1-2-5(4-6)7(12)13/h1-4H,(H,12,13)
InChIKey
FQXQBFUUVCDIRK-UHFFFAOYSA-N
Vapor Pressure
9.87E-03 mm Hg
Boiling Point
238.5 ° C
log P (octanol-water)
2.95
Henry's Law Constant
9.42E-07 atm-m3/mole
Atmospheric OH Rate Constant
6.65E-13 cm3/molecule-sec
Water solubility
149 mg/L
Melting Point
105.5 ° C
Boiling Point
238.5 °C775 mm Hg
BRN Number
2049239
Flash Point
237-240°C
Melting Point
104-106 °C
Class
