940002-57-3

Name Sitagliptin N-Sulfate
CAS 940002-57-3
Molecular Formula C16H15F6N5O4S
MDL Number MFCD11977926
Molecular Weight 487.38
MOL File 940002-57-3.mol

Chemical Properties

Melting point  209-212°C
density  1.75±0.1 g/cm3(Predicted)
storage temp.  Hygroscopic, Refrigerator, Under Inert Atmosphere
solubility  Ethyl Acetate (Slightly), Methanol (Slightly)
form  Solid
pka 0.93±0.50(Predicted)
color  White to Off-White
InChIKey AOWQKFDVSZMKPA-SECBINFHSA-N
SMILES S(N[C@H](CC1=CC(F)=C(F)C=C1F)CC(N1CCN2C(C(F)(F)F)=NN=C2C1)=O)(O)(=O)=O

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