3,5-Difluorophenylacetic acid
Bezeichnung:3,5-Difluorophenylacetic acid
CAS-Nr105184-38-1
Englisch Name:3,5-Difluorophenylacetic acid
CBNumberCB4381985
SummenformelC8H6F2O2
Molgewicht172.13
MOL-Datei105184-38-1.mol
3,5-Difluorophenylacetic acid physikalisch-chemischer Eigenschaften
| Schmelzpunkt | 68-70 °C (lit.) |
| Siedepunkt | 219°C (rough estimate) |
| Dichte | 1.3010 (estimate) |
| storage temp. | Sealed in dry,Room Temperature |
| Löslichkeit | soluble in Methanol |
| Aggregatzustand | powder to crystal |
| pka | 3.90±0.10(Predicted) |
| Farbe | 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) |
| InChIKey | IGGNSAVLXJKCNH-UHFFFAOYSA-N |
| SMILES | C1(CC(O)=O)=CC(F)=CC(F)=C1 |
| CAS Datenbank | 105184-38-1(CAS DataBase Reference) |
| Kennzeichnung gefährlicher | Xi |
| R-Sätze: | 36/37/38 |
| S-Sätze: | 26-36-36/37/39-22-22/26/36/37/39 |
| WGK Germany | 3 |
| HazardClass | IRRITANT |
| HS Code | 29163990 |
