| Melting point |
125-128 °C |
| Boiling point |
337.96°C (rough estimate) |
| Density |
1.1131 (rough estimate) |
| refractive index |
1.6660 (estimate) |
| storage temp. |
under inert gas (nitrogen or Argon) at 2-8°C |
| solubility |
soluble in DMSO, Methanol |
| pka |
-0.95±0.10(Predicted) |
| form |
Solid |
| color |
White |
| InChI |
InChI=1S/C12H12N2O/c1-9-12(8-15)10(2)14(13-9)11-6-4-3-5-7-11/h3-8H,1-2H3 |
| InChIKey |
VOMRTQQGXWPTJK-UHFFFAOYSA-N |
| SMILES |
N1(C2=CC=CC=C2)C(C)=C(C=O)C(C)=N1 |
| CAS DataBase Reference |
22042-79-1(CAS DataBase Reference) |
| EPA Substance Registry System |
1H-Pyrazole-4-carboxaldehyde, 3,5-dimethyl-1-phenyl- (22042-79-1) |
