4-Amino-2-(trifluoromethyl)benzonitrile
- Product Name4-Amino-2-(trifluoromethyl)benzonitrile
- CAS654-70-6
- CBNumberCB9296914
- MFC8H5F3N2
- MW186.13
- EINECS-0
- MDL NumberMFCD00042155
- MOL File654-70-6.mol
- MSDS FileSDS
Chemical Properties
| Melting point | 141-145 °C(lit.) |
| Boiling point | 294.5±40.0 °C(Predicted) |
| Density | 1.37±0.1 g/cm3(Predicted) |
| storage temp. | Keep in dark place,Sealed in dry,Room Temperature |
| solubility | DMSO (Sparingly), Methanol (Slightly) |
| pka | 0.50±0.10(Predicted) |
| form | Powder |
| color | White to off-white |
| BRN | 3278074 |
| InChI | InChI=1S/C8H5F3N2/c9-8(10,11)7-3-6(13)2-1-5(7)4-12/h1-3H,13H2 |
| InChIKey | PMDYLCUKSLBUHO-UHFFFAOYSA-N |
| SMILES | C(#N)C1=CC=C(N)C=C1C(F)(F)F |
| CAS DataBase Reference | 654-70-6(CAS DataBase Reference) |
| FDA UNII | L47D9XHC08 |
| NIST Chemistry Reference | 5-Amino-2-cyanobenzotrifluoride(654-70-6) |
| UNSPSC Code | 41116107 |
| NACRES | NA.24 |
Safety
| Symbol(GHS) |
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| Signal word | Warning | |||||||||
| Hazard statements | H302-H317 | |||||||||
| Precautionary statements | P261-P264-P280-P301+P312+P330-P302+P352-P333+P313 | |||||||||
| Hazard Codes | Xn,T | |||||||||
| Risk Statements | 22-43-36/37/38-20/21/22 | |||||||||
| Safety Statements | 36-45-37/39-26 | |||||||||
| RIDADR | 3439 | |||||||||
| WGK Germany | 3 | |||||||||
| Hazard Note | Toxic | |||||||||
| HazardClass | 6.1 | |||||||||
| PackingGroup | III | |||||||||
| HS Code | 29049090 | |||||||||
| Storage Class | 11 - Combustible Solids | |||||||||
| Hazard Classifications | Acute Tox. 4 Oral Skin Sens. 1 | |||||||||
| NFPA 704: |
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