69004-04-2

Name Ponazuril
CAS 69004-04-2
EINECS(EC#) 629-740-8
Molecular Formula C18H14F3N3O6S
MDL Number MFCD09263475
Molecular Weight 457.38
MOL File 69004-04-2.mol

Chemical Properties

Melting point  242°
density  1.507±0.06 g/cm3(Predicted)
storage temp.  Refrigerator
solubility  Acetontrile (Slightly), DMSO (Slightly), Methanol (Slightly)
form  neat
pka 6.46±0.20(Predicted)
color  White to Off-White
InChI InChI=1S/C18H14F3N3O6S/c1-10-9-11(24-16(26)22-15(25)23(2)17(24)27)3-8-14(10)30-12-4-6-13(7-5-12)31(28,29)18(19,20)21/h3-9H,1-2H3,(H,22,25,26)
InChIKey VBUNOIXRZNJNAD-UHFFFAOYSA-N
SMILES N1(C)C(=O)NC(=O)N(C2=CC=C(OC3=CC=C(S(C(F)(F)F)(=O)=O)C=C3)C(C)=C2)C1=O
CAS DataBase Reference 69004-04-2

Safety Data

Symbol(GHS)  Exclamation Mark (GHS07)
GHS07
Signal word  Warning
Hazard statements  H302-H315-H319-H335
Precautionary statements  P261-P280-P301+P312-P302+P352-P305+P351+P338
WGK Germany  3

Hazard Information

Spectrum Detail

Supplier