139756-21-1
| Name | 5-(2-ETHOXYPHENYL)-1-METHYL-3-N-PROPYL-1,6-DIHYDRO-7H-PYRAZOLO[4,3-D]-7-PYRIMIDINONE |
| CAS | 139756-21-1 |
| Molecular Formula | C17H20N4O2 |
| MDL Number | MFCD03093929 |
| Molecular Weight | 312.37 |
| MOL File | 139756-21-1.mol |
Chemical Properties
| Appearance | Light-Yellow Solid |
| Melting point | 141-145 °C(lit.) |
| density | 1.26±0.1 g/cm3(Predicted) |
| storage temp. | Refrigerator |
| solubility | DMSO (Slightly), Methanol (Slightly) |
| form | Solid |
| pka | 10.27±0.20(Predicted) |
| color | White to Pale Beige |
| InChI | InChI=1S/C17H20N4O2/c1-4-8-12-14-15(21(3)20-12)17(22)19-16(18-14)11-9-6-7-10-13(11)23-5-2/h6-7,9-10H,4-5,8H2,1-3H3,(H,18,19,22) |
| InChIKey | MXQUEDUMKWBYHI-UHFFFAOYSA-N |
| SMILES | C1(C2=CC=CC=C2OCC)NC(=O)C2N(C)N=C(CCC)C=2N=1 |
| CAS DataBase Reference | 139756-21-1 |
Safety Data
| Symbol(GHS) |  GHS07 |
| Signal word | Warning |
| Hazard statements | H315-H319-H335 |
| Precautionary statements | P261-P264-P271-P280-P302+P352-P305+P351+P338 |
| Hazard Codes | Xi |
| Risk Statements | |
| Safety Statements | |
| WGK Germany | 3 |
| HS Code | 2933998090 |
| Storage Class | 11 - Combustible Solids |
| Hazard Classifications | Eye Irrit. 2 Skin Irrit. 2 STOT SE 3 |