Diethyl fluoromalonate
- CAS NO.：685-88-1
- Empirical Formula: C7H11FO4
- Molecular Weight: 178.16
- MDL number: MFCD00009139
- EINECS: 211-684-7
- SAFETY DATA SHEET (SDS)
- Update Date: 2024-11-20 15:18:15
What is Diethyl fluoromalonate?
Chemical properties
CLEAR COLOURLESS TO PALE YELLOW LIQUID
The Uses of Diethyl fluoromalonate
The kinetic parameters of diethyl fluoromalonate in hemolysates were used to study carboxylesterase activities in complex systems.
General Description
The reaction of diethyl fluoromalonate with electron-poor and electron-rich, sterically hindered and unhindered aryl bromides and chlorides were studied.
Properties of Diethyl fluoromalonate
| Boiling point: | 121-122 °C30 mm Hg(lit.) |
| Density | 1.129 g/mL at 25 °C(lit.) |
| refractive index | n |
| Flash point: | 144 °F |
| storage temp. | under inert gas (nitrogen or Argon) at 2-8°C |
| form | Liquid |
| pka | 10.40±0.46(Predicted) |
| Specific Gravity | 1.129 |
| color | Clear colorless to pale yellow |
| BRN | 1775686 |
| InChI | InChI=1S/C7H11FO4/c1-3-11-6(9)5(8)7(10)12-4-2/h5H,3-4H2,1-2H3 |
| CAS DataBase Reference | 685-88-1(CAS DataBase Reference) |
| NIST Chemistry Reference | Diethyl fluoromalonate(685-88-1) |
Safety information for Diethyl fluoromalonate
| Signal word | Danger |
| Pictogram(s) |
 Corrosion Corrosives GHS05 |
| GHS Hazard Statements |
H314:Skin corrosion/irritation |
| Precautionary Statement Codes |
P280:Wear protective gloves/protective clothing/eye protection/face protection. P363:Wash contaminated clothing before reuse. P303+P361+P353:IF ON SKIN (or hair): Remove/Take off Immediately all contaminated clothing. Rinse SKIN with water/shower. 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 Diethyl fluoromalonate
| InChIKey | GOWQBFVDZPZZFA-UHFFFAOYSA-N |
| SMILES | C(OCC)(=O)C(F)C(OCC)=O |
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