1,3,5-Trimethyl-1H-pyrazole-4-carboxylic acid
Bezeichnung:1,3,5-Trimethyl-1H-pyrazole-4-carboxylic acid
CAS-Nr1125-29-7
Englisch Name:1,3,5-Trimethyl-1H-pyrazole-4-carboxylic acid
CBNumberCB5167016
SummenformelC7H10N2O2
Molgewicht154.17
MOL-Datei1125-29-7.mol
1,3,5-Trimethyl-1H-pyrazole-4-carboxylic acid physikalisch-chemischer Eigenschaften
| Schmelzpunkt | 215-217°C |
| Siedepunkt | 297.6±35.0 °C(Predicted) |
| Dichte | 1.24±0.1 g/cm3(Predicted) |
| storage temp. | Refrigerator, under inert atmosphere |
| Löslichkeit | DMSO (Slightly), Methanol (Slightly) |
| Aggregatzustand | Solid |
| pka | 3.73±0.10(Predicted) |
| Farbe | White to Off-White |
| InChI | InChI=1S/C7H10N2O2/c1-4-6(7(10)11)5(2)9(3)8-4/h1-3H3,(H,10,11) |
| InChIKey | NOIOGQJFLIPRBI-UHFFFAOYSA-N |
| SMILES | N1(C)C(C)=C(C(O)=O)C(C)=N1 |
| CAS Datenbank | 1125-29-7(CAS DataBase Reference) |
| Kennzeichnung gefährlicher | Xi |
| R-Sätze: | 36/37/38 |
| S-Sätze: | 26-36/37/39 |
| HazardClass | IRRITANT |
| HS Code | 29331990 |
