CAS 433-97-6|2-(Trifluoromethyl)benzoic acid
Introduction：Basic information about CAS 433-97-6|2-(Trifluoromethyl)benzoic acid, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | 2-(Trifluoromethyl)benzoic acid | ||
|---|---|---|---|
| CAS Number | 433-97-6 | Molecular Weight | 190.119 |
| Density | 1.4±0.1 g/cm3 | Boiling Point | 243.7±40.0 °C at 760 mmHg |
| Molecular Formula | C8H5F3O2 | Melting Point | 110-112ºC |
| MSDS | ChineseUSA | Flash Point | 101.2±27.3 °C |
| Symbol | GHS07 | Signal Word | Warning |
Names
| Name | 2-(trifluoromethyl)benzoic acid |
|---|---|
| Synonym | More Synonyms |
Chemical & Physical Properties
| Density | 1.4±0.1 g/cm3 |
|---|---|
| Boiling Point | 243.7±40.0 °C at 760 mmHg |
| Melting Point | 110-112ºC |
| Molecular Formula | C8H5F3O2 |
| Molecular Weight | 190.119 |
| Flash Point | 101.2±27.3 °C |
| Exact Mass | 190.024170 |
| PSA | 37.30000 |
| LogP | 2.87 |
| Vapour Pressure | 0.0±0.5 mmHg at 25°C |
| Index of Refraction | 1.475 |
| InChIKey | FBRJYBGLCHWYOE-UHFFFAOYSA-N |
| SMILES | O=C(O)c1ccccc1C(F)(F)F |
Safety Information
| Symbol | GHS07 |
|---|---|
| Signal Word | Warning |
| Hazard Statements | H315-H319-H335 |
| Precautionary Statements | P261-P305 + P351 + P338 |
| Personal Protective Equipment | dust mask type N95 (US);Eyeshields;Gloves |
| Hazard Codes | Xi:Irritant |
| Risk Phrases | R36/37/38 |
| Safety Phrases | S26-S36 |
| RIDADR | UN 1549 6.1/PG 3 |
| WGK Germany | 2 |
| HS Code | 2916399090 |
Customs
| HS Code | 2916399090 |
|---|---|
| Summary | 2916399090 other aromatic monocarboxylic acids, their anhydrides, halides, peroxides, peroxyacids and their derivatives VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:6.5% General tariff:30.0% |
Articles4
More Articles| Studies on the metabolism of fluorinated xenobiotics in the rat using 19F-NMR and 1H-NMR spectroscopy. J. Pharm. Biomed. Anal. 8(8-12) , 939-44, (1990) | |
| Synthesis, characterization and biological activity of some new 1,3,4-oxadiazole bearing 2-flouro-4-methoxy phenyl moiety. Eur. J. Med. Chem. 45(3) , 1206-10, (2010) In the present study a series of new 1,3,4-oxadiazole derivatives containing 2-fluoro-4-methoxy moiety were synthesized. These newly synthesized compounds were characterized by NMR, mass spectral, IR ... | |
| Use of 19F NMR spectroscopy to screen chemical libraries for ligands that bind to proteins. Org. Biomol. Chem. 2(5) , 725-31, (2004) Identification of compounds from chemical libraries that bind to macromolecules by use of NMR spectroscopy has gained increasing importance during recent years. A simple methodology based on (19)F NMR... |
Synonyms
| Alpha,Alpha,Alpha-Trifluoro-o-Toluic Acid |
| MFCD00003482 |
| 2-(Trifluoromethyl)benzoic acid |
| 2-Carboxybenzotrifluoride |
| EINECS 240-989-8 |
| α,α,α-Trifluoro-o-toluic acid |
| QVR BXFFF |
| Benzoic acid, 2-(trifluoromethyl)- |
| 2-(Trifluoromethyl)benzoicacid |
