69004-15-5
| Name | 1-Methyl-3-{3-methyl-4-[4-(trifluormethylsulfinyl)-phenoxy]-phenyl}-1,3,5-triazin-2,4,6(1H,3H,5H)-trion |
| CAS | 69004-15-5 |
| Molecular Formula | C18H14F3N3O5S |
| MDL Number | MFCD10567359 |
| Molecular Weight | 441.38 |
| MOL File | 69004-15-5.mol |
Chemical Properties
| Melting point | >212°C (dec.) |
| storage temp. | -20°C Freezer |
| solubility | Chloroform (Slightly), Methanol (Slightly), Water (Slightly) |
| form | neat |
| color | White to Off-White |
| Major Application | forensics and toxicology pharmaceutical (small molecule) veterinary |
| InChI | 1S/C18H14F3N3O5S/c1-10-9-11(24-16(26)22-15(25)23(2)17(24)27)3-8-14(10)29-12-4-6-13(7-5-12)30(28)18(19,20)21/h3-9H,1-2H3,(H,22,25,26) |
| InChIKey | QWKYIPKCLAUFCM-UHFFFAOYSA-N |
| SMILES | CN1C(=O)NC(=O)N(C1=O)c2ccc(Oc3ccc(cc3)S(=O)C(F)(F)F)c(C)c2 |
Safety Data
| Symbol(GHS) |  GHS09 |
| Signal word | Warning |
| Hazard statements | H410-H400 |
| Precautionary statements | P273-P391-P501-P273-P391-P501 |
| WGK Germany | 3 |
| HS Code | 2933699090 |
| Storage Class | 11 - Combustible Solids |