802906-73-6

Name CTEP Derivative
CAS 802906-73-6
Molecular Formula C18H13ClFN3
MDL Number MFCD25976719
Molecular Weight 325.77
MOL File 802906-73-6.mol

Chemical Properties

Melting point  132 - 135°C
Boiling point  526.6±60.0 °C(Predicted)
density  1.21±0.1 g/cm3(Predicted)
storage temp.  Hygroscopic, -20°C Freezer, Under inert atmosphere
solubility  DMSO (Slightly), Methanol (Slightly)
form  Solid
pka 5.27±0.70(Predicted)
color  Pale Brown to Light Brown
Stability: Hygroscopic, Moisture Sensitive
InChI InChI=1S/C18H13ClFN3/c1-12-17(8-3-14-9-10-21-18(19)11-14)22-13(2)23(12)16-6-4-15(20)5-7-16/h4-7,9-11H,1-2H3
InChIKey UPZWINBEAHDTLA-UHFFFAOYSA-N
SMILES C1(Cl)=NC=CC(C#CC2=C(C)N(C3=CC=C(F)C=C3)C(C)=N2)=C1

Safety Data

Symbol(GHS)  Exclamation Mark (GHS07)
GHS07
Signal word  Warning
Hazard statements  H302-H315-H320-H335
Precautionary statements  P264-P270-P301+P312-P330

Hazard Information

Supplier