3,4,5-Trifluorobenzoic acid
- CAS NO.：121602-93-5
- Empirical Formula: C7H3F3O2
- Molecular Weight: 176.09
- MDL number: MFCD00074962
- EINECS: 624-063-4
- SAFETY DATA SHEET (SDS)
- Update Date: 2024-04-01 18:08:31
What is 3,4,5-Trifluorobenzoic acid?
Chemical properties
white to light yellow crystal powder
The Uses of 3,4,5-Trifluorobenzoic acid
3,4,5-Trifluorobenzoic acid may be used in chemical synthesis.
The Uses of 3,4,5-Trifluorobenzoic acid
3,4,5-Trifluorobenzoic acid is an isomer of 2,3,6-Trifluorobenzoic acid (T790050), and both are deriatives of Benzoic acid (B203900). 3,4,5-Trifluorobenzoic acid is also part of a group of compounds that have potential inhibitory activity towards d-amino acid oxidases, deeming them capable of treating mental disorders such as schizophrenia.
Properties of 3,4,5-Trifluorobenzoic acid
| Melting point: | 97-99 °C (lit.) |
| Boiling point: | 116-118C/100Torr |
| Density | 1,12g/cm |
| refractive index | 1,471-1,473 |
| storage temp. | Sealed in dry,Room Temperature |
| form | powder to crystal |
| pka | 3.46±0.10(Predicted) |
| color | White to Almost white |
| BRN | 7476737 |
| CAS DataBase Reference | 121602-93-5(CAS DataBase Reference) |
| EPA Substance Registry System | Benzoic acid, 3,4,5-trifluoro- (121602-93-5) |
Safety information for 3,4,5-Trifluorobenzoic 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. P271:Use only outdoors or in a well-ventilated area. P280:Wear protective gloves/protective clothing/eye protection/face protection. P302+P352:IF ON SKIN: wash with plenty of soap and water. P305+P351+P338:IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continuerinsing. |
Computed Descriptors for 3,4,5-Trifluorobenzoic acid
| InChIKey | VJMYKESYFHYUEQ-UHFFFAOYSA-N |
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