3,5-Difluorophenylacetic acid
- CAS NO.：105184-38-1
- Empirical Formula: C8H6F2O2
- Molecular Weight: 172.13
- MDL number: MFCD00010316
- EINECS: 626-119-3
- SAFETY DATA SHEET (SDS)
- Update Date: 2024-08-27 20:28:20
What is 3,5-Difluorophenylacetic acid?
Chemical properties
light yellow crystalline powder
The Uses of 3,5-Difluorophenylacetic acid
3,5-Difluorophenylacetic acid has been used in the synthesis of:
- N-[N-(3,5-difluorophenylacetyl)-L-alanyl]-L-phenylglycine tert-butyl ester
- N-acylalanine
What are the applications of Application
3,5-Difluorophenylacetic acid is an intermediate
General Description
3,5-Difluorophenylacetic acid is an important pharmaceutical intermediate.
Properties of 3,5-Difluorophenylacetic acid
| Melting point: | 68-70 °C (lit.) |
| Boiling point: | 219°C (rough estimate) |
| Density | 1.3010 (estimate) |
| storage temp. | Sealed in dry,Room Temperature |
| solubility | soluble in Methanol |
| form | powder to crystal |
| pka | 3.90±0.10(Predicted) |
| color | White to Light yellow |
| BRN | 3605064 |
| InChI | InChI=1S/C8H6F2O2/c9-6-1-5(3-8(11)12)2-7(10)4-6/h1-2,4H,3H2,(H,11,12) |
| CAS DataBase Reference | 105184-38-1(CAS DataBase Reference) |
Safety information for 3,5-Difluorophenylacetic 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 3,5-Difluorophenylacetic acid
| InChIKey | IGGNSAVLXJKCNH-UHFFFAOYSA-N |
| SMILES | C1(CC(O)=O)=CC(F)=CC(F)=C1 |
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