78583-81-0
| Name | 3-(4-CHLOROPHENYL)-1H-PYRAZOL-5-AMINE |
| CAS | 78583-81-0 |
| Molecular Formula | C9H8ClN3 |
| MDL Number | MFCD00053046 |
| Molecular Weight | 193.63 |
| MOL File | 78583-81-0.mol |
Chemical Properties
| Melting point | 172-176 °C(lit.) |
| Boiling point | 463.8±35.0 °C(Predicted) |
| density | 1.378±0.06 g/cm3(Predicted) |
| storage temp. | 2-8°C, protect from light |
| solubility | soluble in Methanol |
| form | powder to crystal |
| pka | 14.08±0.10(Predicted) |
| color | White to Almost white |
| InChI | 1S/C9H8ClN3/c10-7-3-1-6(2-4-7)8-5-9(11)13-12-8/h1-5H,(H3,11,12,13) |
| InChIKey | XQPBZIITFQHIDI-UHFFFAOYSA-N |
| SMILES | Nc1cc(n[nH]1)-c2ccc(Cl)cc2 |
| CAS DataBase Reference | 78583-81-0(CAS DataBase Reference) |
Safety Data
| Hazard Codes | Xn,Xi |
| Risk Statements | |
| Safety Statements | |
| WGK Germany | 3 |
| HazardClass | IRRITANT |
| HS Code | 2933199090 |
| Storage Class | 11 - Combustible Solids |
| Hazard Classifications | Acute Tox. 4 Oral Eye Dam. 1 Skin Irrit. 2 STOT SE 3 |