Ethyl 2,4,5-trifluorobenzoylacetate
- CAS NO.：98349-24-7
- Empirical Formula: C11H9F3O3
- Molecular Weight: 246.18
- MDL number: MFCD00792431
- SAFETY DATA SHEET (SDS)
- Update Date: 2025-07-24 18:13:52
What is Ethyl 2,4,5-trifluorobenzoylacetate?
Chemical properties
off-white crystall powder
The Uses of Ethyl 2,4,5-trifluorobenzoylacetate
Ethyl 2,4,5-Trifluoro-β-oxobenzenepropanoate can be used to prepare aminopyrrolidinyl)quinolinecarboxylates with antitumor activities.
Properties of Ethyl 2,4,5-trifluorobenzoylacetate
| Melting point: | 66-68°C |
| Boiling point: | 92 °C(Press: 0.08 Torr) |
| Density | 1.319±0.06 g/cm3(Predicted) |
| storage temp. | under inert gas (nitrogen or Argon) at 2-8°C |
| solubility | soluble in Toluene |
| form | powder to crystal |
| pka | 10.26±0.50(Predicted) |
| color | White to Almost white |
| InChI | InChI=1S/C11H9F3O3/c1-2-17-11(16)5-10(15)6-3-8(13)9(14)4-7(6)12/h3-4H,2,5H2,1H3 |
| CAS DataBase Reference | 98349-24-7(CAS DataBase Reference) |
Safety information for Ethyl 2,4,5-trifluorobenzoylacetate
| 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. P271:Use only outdoors or in a well-ventilated area. P280:Wear protective gloves/protective clothing/eye protection/face protection. |
Computed Descriptors for Ethyl 2,4,5-trifluorobenzoylacetate
| InChIKey | OTCJYVJORKMTHX-UHFFFAOYSA-N |
| SMILES | C1(C(=O)CC(=O)OCC)C=C(C(F)=CC=1F)F |
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