3-(Trifluoromethyl)benzaldehyde
Synonym(s):α,α,α-Trifluoro-m-tolualdehyde
- CAS NO.：454-89-7
- Empirical Formula: C8H5F3O
- Molecular Weight: 174.12
- MDL number: MFCD00003373
- EINECS: 207-228-1
- SAFETY DATA SHEET (SDS)
- Update Date: 2026-02-25 11:45:28
What is 3-(Trifluoromethyl)benzaldehyde?
Chemical properties
CLEAR COLOURLESS TO VERY SLIGHTLY ORANGE LIQUID
The Uses of 3-(Trifluoromethyl)benzaldehyde
3-(Trifluoromethyl)benzaldehyde is used as a reagent in the synthesis of 2,3-di- and 2,2,3-trisubstituted-3-methoxycarbonyl-╬│-butyrolactones as potent antitumor agents. Also used as a reagent in the synthesis of novel chalcone derivatives as hypoxia-inducible factor (HIF)-1 inhibitors.
Synthesis Reference(s)
Journal of the American Chemical Society, 68, p. 426, 1946 DOI: 10.1021/ja01207a024
General Description
Aldol reaction of 3-(trifluoromethyl)benzaldehyde with hydroxyacetone in the aldolase antibody 38C2-ionic liquid system has been investigated.
Properties of 3-(Trifluoromethyl)benzaldehyde
| Boiling point: | 83-86 °C30 mm Hg(lit.) |
| Density | 1.301 g/mL at 25 °C(lit.) |
| refractive index | n |
| Flash point: | 155 °F |
| storage temp. | Keep in dark place,Sealed in dry,Room Temperature |
| solubility | Chloroform (Slightly), Methanol (Slightly) |
| form | Liquid |
| Specific Gravity | 1.301 |
| color | Clear colorless to very slightly orange |
| Sensitive | Air Sensitive |
| BRN | 2327537 |
| CAS DataBase Reference | 454-89-7(CAS DataBase Reference) |
| NIST Chemistry Reference | Benzaldehyde, 3-(trifluoromethyl)-(454-89-7) |
| EPA Substance Registry System | Benzaldehyde, 3-(trifluoromethyl)- (454-89-7) |
Safety information for 3-(Trifluoromethyl)benzaldehyde
| Signal word | Warning |
| Pictogram(s) |
 Exclamation Mark Irritant GHS07  Environment GHS09 |
| GHS Hazard Statements |
H315:Skin corrosion/irritation H319:Serious eye damage/eye irritation H335:Specific target organ toxicity, single exposure;Respiratory tract irritation H410:Hazardous to the aquatic environment, long-term hazard |
| 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. P273:Avoid release to the environment. 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-(Trifluoromethyl)benzaldehyde
| InChIKey | NMTUHPSKJJYGML-UHFFFAOYSA-N |
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