769169-27-9

Name Begacestat
CAS 769169-27-9
Molecular Formula C9H8ClF6NO3S2
MDL Number MFCD18782675
Molecular Weight 391.74
MOL File 769169-27-9.mol

Chemical Properties

Melting point  153-155°C
Boiling point  355℃
density  1.642
Fp  169℃
storage temp.  2-8°C
solubility  DMSO: ≥15mg/mL
form  powder
pka 8.16±0.50(Predicted)
color  white to tan
InChI 1S/C9H8ClF6NO3S2/c10-5-1-2-6(21-5)22(19,20)17-4(3-18)7(8(11,12)13)9(14,15)16/h1-2,4,7,17-18H,3H2/t4-/m1/s1
InChIKey PSXOKXJMVRSARX-SCSAIBSYSA-N
SMILES OC[C@@H](NS(=O)(=O)c1ccc(Cl)s1)C(C(F)(F)F)C(F)(F)F

Safety Data

WGK Germany  3
Storage Class 11 - Combustible Solids

Hazard Information

Supplier