175205-09-1
| Name | 5-[3,5-BIS(TRIFLUOROMETHYL)PHENYL]TETRAZOLE |
| CAS | 175205-09-1 |
| Molecular Formula | C9H4F6N4 |
| MDL Number | MFCD00052524 |
| Molecular Weight | 282.15 |
| MOL File | 175205-09-1.mol |
Chemical Properties
| Melting point | 177-180°C |
| Boiling point | 298.2±50.0 °C(Predicted) |
| density | 1.569±0.06 g/cm3(Predicted) |
| Fp | 5℃ |
| storage temp. | Sealed in dry,2-8°C |
| solubility | DMSO: soluble20mg/mL, clear |
| form | powder |
| pka | 3.59±0.10(Predicted) |
| color | white to beige |
| InChI | 1S/C9H4F6N4/c10-8(11,12)5-1-4(7-16-18-19-17-7)2-6(3-5)9(13,14)15/h1-3H,(H,16,17,18,19) |
| InChIKey | KKJFZIQEWZVVIV-UHFFFAOYSA-N |
| SMILES | FC(F)(F)c1cc(cc(c1)c2n[nH]nn2)C(F)(F)F |
| CAS DataBase Reference | 175205-09-1(CAS DataBase Reference) |
Safety Data
| Hazard Codes | Xi |
| Risk Statements | |
| Safety Statements | |
| RIDADR | UN 2811 6.1 / PGIII |
| WGK Germany | 3 |
| Hazard Note | Irritant |
| Storage Class | 3 - Flammable liquids |
| Hazard Classifications | Acute Tox. 4 Dermal Acute Tox. 4 Inhalation Acute Tox. 4 Oral Eye Irrit. 2 Flam. Liq. 2 Skin Irrit. 2 |