70585-35-2
| Name | (aR,)-rel-a-tert-Butyl-b-(4-chlorophenoxy)-1H-1,2,4-triazole-1-ethanol PESTANAL |
| CAS | 70585-35-2 |
| Molecular Formula | C14H18ClN3O2 |
| MDL Number | MFCD31656807 |
| Molecular Weight | 295.76 |
| MOL File | 70585-35-2.mol |
Chemical Properties
| Boiling point | 465.4±55.0 °C(Predicted) |
| density | 1.24±0.1 g/cm3(Predicted) |
| Fp | 100 °C |
| pka | 13.29±0.20(Predicted) |
| Major Application | agriculture environmental |
| InChI | 1S/C14H18ClN3O2/c1-14(2,3)12(19)13(18-9-16-8-17-18)20-11-6-4-10(15)5-7-11/h4-9,12-13,19H,1-3H3/t12-,13-/m0/s1 |
| InChIKey | BAZVSMNPJJMILC-STQMWFEESA-N |
| SMILES | CC(C)(C)[C@@H](O)[C@H](Oc1ccc(Cl)cc1)n2cncn2 |
Safety Data
| Hazard Codes | Xn |
| Risk Statements | |
| Safety Statements | |
| WGK Germany | 2 |
| Storage Class | 11 - Combustible Solids |
| Hazard Classifications | Acute Tox. 4 Oral |