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) |
NIST Chemistry Reference |
5-Amino-2-cyanobenzotrifluoride(654-70-6) |