210631-68-8
| Name | TOPRAMEZONE |
| CAS | 210631-68-8 |
| Molecular Formula | C16H17N3O5S |
| MDL Number | MFCD09953760 |
| Molecular Weight | 363.39 |
| MOL File | 210631-68-8.mol |
Chemical Properties
| Boiling point | 590.5±60.0 °C(Predicted) |
| density | 1.49±0.1 g/cm3(Predicted) |
| solubility | Chloroform (Slightly, Heated), Water (Slightly, Heated) |
| form | neat |
| pka | 6.35±0.50(Predicted) |
| color | Light yellow to yellow |
| Major Application | agriculture environmental |
| InChI | InChI=1S/C16H17N3O5S/c1-9-10(15(20)11-8-17-19(2)16(11)21)4-5-13(25(3,22)23)14(9)12-6-7-24-18-12/h4-5,8,21H,6-7H2,1-3H3 |
| InChIKey | IYMLUHWAJFXAQP-UHFFFAOYSA-N |
| SMILES | C(C1=CC=C(S(C)(=O)=O)C(C2CCON=2)=C1C)(C1=C(O)N(C)N=C1)=O |
| LogP | 0.957 (est) |
| EPA Substance Registry System | Methanone, [3-(4,5-dihydro-3-isoxazolyl)-2-methyl-4-(methylsulfonyl)phenyl](5-hydroxy-1-methyl-1H-pyrazol-4-yl)- (210631-68-8) |
Safety Data
| Hazard Codes | T,N |
| Risk Statements | |
| Safety Statements | |
| RIDADR | UN3077 9/PG 3 |
| WGK Germany | 1 |
| Storage Class | 6.1C - Combustible acute toxic Cat.3 toxic compounds or compounds which causing chronic effects |
| Hazard Classifications | Aquatic Acute 1 Aquatic Chronic 1 Repr. 1B |
| Hazardous Substances Data | 210631-68-8(Hazardous Substances Data) |