321-07-3

Name 1-PHENYL-3-(TRIFLUOROMETHYL)-2-PYRAZOLIN-5-ONE
CAS 321-07-3
Molecular Formula C10H7F3N2O
MDL Number MFCD00051655
Molecular Weight 228.17
MOL File 321-07-3.mol
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Chemical Properties

Melting point  195-196°C
Boiling point  278.7±40.0 °C(Predicted)
density  1.39±0.1 g/cm3(Predicted)
storage temp.  Store at room temperature
form  crystalline powder
pka -0.22±0.50(Predicted)
color  Faint beige
BRN  655085
InChI InChI=1S/C10H7F3N2O/c11-10(12,13)8-6-9(16)15(14-8)7-4-2-1-3-5-7/h1-5H,6H2
InChIKey GLGRRRKQSFURGD-UHFFFAOYSA-N
SMILES N1=C(C(F)(F)F)CC(=O)N1C1=CC=CC=C1
CAS DataBase Reference 321-07-3(CAS DataBase Reference)

Safety Data

Hazard Codes  Xi
Risk Statements 
R36/37/38:Irritating to eyes, respiratory system and skin .
Safety Statements 
S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S36:Wear suitable protective clothing .
Hazard Note  Irritant
HS Code  2933119000

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