3-[(5-Chloro-2-hydroxyphenyl)methyl]-5-[4-(trifluoromethyl)phenyl]-1,3,4-oxadiazol-2(3H)-one
- Product Name3-[(5-Chloro-2-hydroxyphenyl)methyl]-5-[4-(trifluoromethyl)phenyl]-1,3,4-oxadiazol-2(3H)-one
- CAS202821-81-6
- CBNumberCB02450344
- MFC16H10ClF3N2O3
- MW370.71
- MDL NumberMFCD09753285
- MOL File202821-81-6.mol
Chemical Properties
| Boiling point: | 444.0±55.0 °C(Predicted) |
| Density | 1.51±0.1 g/cm3(Predicted) |
| storage temp. | Store at RT |
| solubility | DMSO: soluble20mg/mL, clear (warmed) |
| form | powder |
| pka | 9.27±0.43(Predicted) |
| color | white to beige |
| InChI | 1S/C16H10ClF3N2O3/c17-12-5-6-13(23)10(7-12)8-22-15(24)25-14(21-22)9-1-3-11(4-2-9)16(18,19)20/h1-7,23H,8H2 |
| InChIKey | QKOWACXSXTXRKA-UHFFFAOYSA-N |
| SMILES | FC(F)(F)c1ccc(cc1)C2=NN(C(=O)O2)Cc3c(ccc(c3)Cl)O |
Safety
| Symbol(GHS) |
![]() GHS06 |
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| Signal word | Danger | |||||||||
| Hazard statements | H301-H413 | |||||||||
| Precautionary statements | P273-P301+P310+P330 | |||||||||
| Hazard Codes | T | |||||||||
| Risk Statements | 25 | |||||||||
| Safety Statements | 45 | |||||||||
| RIDADR | UN 2811 6.1 / PGIII | |||||||||
| WGK Germany | 3 | |||||||||
| HS Code | 2934999090 | |||||||||
| Storage Class |
6.1C - Combustible acute toxic Cat.3 toxic compounds or compounds which causing chronic effects |
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| Hazard Classifications |
Acute Tox. 3 Oral Aquatic Chronic 4 |
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| NFPA 704: |
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