2-FLUORO-3-(TRIFLUOROMETHYL)BENZOIC ACID
- CAS NO.：115029-22-6
- Empirical Formula: C8H4F4O2
- Molecular Weight: 208.11
- MDL number: MFCD00040980
- SAFETY DATA SHEET (SDS)
- Update Date: 2023-12-18 18:11:03
What is 2-FLUORO-3-(TRIFLUOROMETHYL)BENZOIC ACID?
Chemical properties
White to beige crystalline powder
The Uses of 2-FLUORO-3-(TRIFLUOROMETHYL)BENZOIC ACID
2-Fluoro-3-(trifluoromethyl)benzoic acid may be used in chemical synthesis.
Properties of 2-FLUORO-3-(TRIFLUOROMETHYL)BENZOIC ACID
| Melting point: | 126-128 °C (lit.) |
| Boiling point: | 249.6±40.0 °C(Predicted) |
| Density | 1.489±0.06 g/cm3(Predicted) |
| pka | 2.84±0.10(Predicted) |
| form | Crystalline Powder |
| color | White to beige |
| InChI | InChI=1S/C8H4F4O2/c9-6-4(7(13)14)2-1-3-5(6)8(10,11)12/h1-3H,(H,13,14) |
| CAS DataBase Reference | 115029-22-6(CAS DataBase Reference) |
Safety information for 2-FLUORO-3-(TRIFLUOROMETHYL)BENZOIC ACID
| Signal word | Warning |
| Pictogram(s) |
 Exclamation Mark Irritant GHS07 |
| GHS Hazard Statements |
H315:Skin corrosion/irritation H319:Serious eye damage/eye irritation H335:Specific target organ toxicity, single exposure;Respiratory tract irritation |
| Precautionary Statement Codes |
P261:Avoid breathing dust/fume/gas/mist/vapours/spray. P264:Wash hands thoroughly after handling. P264:Wash skin thouroughly after handling. P280:Wear protective gloves/protective clothing/eye protection/face protection. P304+P340:IF INHALED: Remove victim to fresh air and Keep at rest in a position comfortable for breathing. P305+P351+P338:IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continuerinsing. P405:Store locked up. |
Computed Descriptors for 2-FLUORO-3-(TRIFLUOROMETHYL)BENZOIC ACID
| InChIKey | XVEAMDNSCPPPCP-UHFFFAOYSA-N |
| SMILES | C(O)(=O)C1=CC=CC(C(F)(F)F)=C1F |
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