Sitagliptin phosphate
Bezeichnung:Sitagliptin phosphate
CAS-Nr654671-78-0
Englisch Name:Sitagliptin phosphate
CBNumberCB71179744
SummenformelC16H15F6N5O.H3PO4
Molgewicht505.31
MOL-Datei654671-78-0.mol
Sitagliptin phosphate physikalisch-chemischer Eigenschaften
Schmelzpunkt | 202-204°C |
storage temp. | -20°C Freezer |
Löslichkeit | Methanol (Slightly, Heated), Water (Sparingly, Sonicated) |
Aggregatzustand | Solid |
Farbe | White to Off-White |
InChI | InChI=1S/C16H15F6N5O.H3O4P/c17-10-6-12(19)11(18)4-8(10)3-9(23)5-14(28)26-1-2-27-13(7-26)24-25-15(27)16(20,21)22;1-5(2,3)4/h4,6,9H,1-3,5,7,23H2;(H3,1,2,3,4) |
InChIKey | IQFYVLUXQXSJJN-UHFFFAOYSA-N |
SMILES | C(C1=CC(F)=C(F)C=C1F)C(N)CC(=O)N1CCN2C(C(F)(F)F)=NN=C2C1.P(O)(O)(O)=O |