1630808-89-7

Name FT-113
CAS 1630808-89-7
Molecular Formula C22H20FN3O4
Molecular Weight 409.41
MOL File 1630808-89-7.mol
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Chemical Properties

Boiling point  637.6±55.0 °C(Predicted)
density  1.456±0.06 g/cm3(Predicted)
storage temp.  Store at -20°C
solubility  DMSO : 62.5 mg/mL (152.66 mM; Need ultrasonic)
form  Solid
pka 13.92±0.20(Predicted)
color  White to off-white
InChI InChI=1S/C22H20FN3O4/c23-16-5-6-17-18(13-16)30-19(24-17)14-1-3-15(4-2-14)20(27)25-9-11-26(12-10-25)21(28)22(29)7-8-22/h1-6,13,29H,7-12H2
InChIKey DSTWHRGOCUOKDE-UHFFFAOYSA-N
SMILES C(N1CCN(C(=O)C2=CC=C(C3=NC4=CC=C(F)C=C4O3)C=C2)CC1)(C1(O)CC1)=O

Safety Data

Symbol(GHS)  Exclamation Mark (GHS07)
GHS07
Signal word  Warning
Hazard statements  H302-H315-H319-H335
Precautionary statements  P261-P305+P351+P338

Hazard Information

Spectrum Detail

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