172673-20-0

Name Fosaprepitant
CAS 172673-20-0
Molecular Formula C23H22F7N4O6P
MDL Number MFCD00942401
Molecular Weight 614.41
MOL File 172673-20-0.mol

Chemical Properties

Melting point  >74°C (dec.)
density  1.65
storage temp.  Inert atmosphere,Store in freezer, under -20°C
solubility  DMSO, Methanol
form  Solid
pka 2.45±0.20(Predicted)
color  White
InChIKey BARDROPHSZEBKC-OITMNORJSA-N
SMILES P(N1C(=O)N=C(CN2CCO[C@H](O[C@@H](C3=CC(C(F)(F)F)=CC(C(F)(F)F)=C3)C)[C@@H]2C2=CC=C(F)C=C2)N1)(=O)(O)O

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

Hazard Information

Supplier