131983-72-7
| Name | TRITICONAZOLE |
| CAS | 131983-72-7 |
| Molecular Formula | C17H20ClN3O |
| MDL Number | MFCD01632360 |
| Molecular Weight | 317.81 |
| MOL File | 131983-72-7.mol |
Chemical Properties
| Melting point | 143～149℃ |
| Boiling point | 498.7±55.0 °C(Predicted) |
| density | 1.23±0.1 g/cm3(Predicted) |
| storage temp. | 0-6°C |
| solubility | DMF: 30 mg/ml; DMSO: 30 mg/ml; Ethanol: 30 mg/ml; Ethanol:PBS(pH 7.2) (1:1): 0.5 mg/ml |
| form | neat |
| pka | 13.23±0.40(Predicted) |
| Major Application | agriculture environmental |
| InChI | 1S/C17H20ClN3O/c1-16(2)8-7-14(9-13-3-5-15(18)6-4-13)17(16,22)10-21-12-19-11-20-21/h3-6,9,11-12,22H,7-8,10H2,1-2H3/b14-9+ |
| InChIKey | PPDBOQMNKNNODG-NTEUORMPSA-N |
| SMILES | CC1(C)CCC(=C/c2ccc(Cl)cc2)\C1(O)Cn3cncn3 |
| EPA Substance Registry System | Triticonazole (131983-72-7) |
Safety Data
| Hazard Codes | N |
| Risk Statements | |
| Safety Statements | |
| RIDADR | UN3077 9/PG 3 |
| WGK Germany | 2 |
| RTECS | GY4705000 |
| HS Code | 29339900 |
| Storage Class | 11 - Combustible Solids |
| Hazard Classifications | Aquatic Acute 1 Aquatic Chronic 1 Repr. 2 STOT RE 2 |
| Hazardous Substances Data | 131983-72-7(Hazardous Substances Data) |