1-PHENYL-5-(TRIFLUOROMETHYL)-1H-PYRAZOLE-4-CARBOXYLIC ACID
- Product Name1-PHENYL-5-(TRIFLUOROMETHYL)-1H-PYRAZOLE-4-CARBOXYLIC ACID
- CAS98534-81-7
- CBNumberCB1752362
- MFC11H7F3N2O2
- MW256.18
- MDL NumberMFCD00173854
- MOL File98534-81-7.mol
- MSDS FileSDS
Chemical Properties
| Melting point | 134-138 °C (lit.) |
| Boiling point | 368.9±42.0 °C(Predicted) |
| Density | 1.44±0.1 g/cm3(Predicted) |
| storage temp. | Sealed in dry,Room Temperature |
| form | solid |
| pka | 2.80±0.36(Predicted) |
| Appearance | White to off-white Powder |
| InChI | 1S/C11H7F3N2O2/c12-11(13,14)9-8(10(17)18)6-15-16(9)7-4-2-1-3-5-7/h1-6H,(H,17,18) |
| InChIKey | SMPJBTIFNUUWGQ-UHFFFAOYSA-N |
| SMILES | OC(=O)c1cnn(-c2ccccc2)c1C(F)(F)F |
| CAS DataBase Reference | 98534-81-7(CAS DataBase Reference) |
| UNSPSC Code | 12352100 |
| NACRES | NA.22 |
Safety
| Symbol(GHS) |
|
| Signal word | Warning |
| Hazard statements | H302+H312-H315-H319-H335 |
| Precautionary statements | P261-P264-P280-P301+P312-P302+P352+P312-P305+P351+P338 |
| Hazard Codes | Xn,Xi |
| Risk Statements | 21/22-36/37/38 |
| Safety Statements | 26-36/37 |
| WGK Germany | 3 |
| Hazard Note | Irritant |
| HS Code | 2933199090 |
| Storage Class | 11 - Combustible Solids |
| Hazard Classifications | Acute Tox. 4 Oral Eye Irrit. 2 Skin Irrit. 2 STOT SE 3 |
