145416-34-8

Name 2-epi-(-)-EMtricitabine
CAS 145416-34-8
Molecular Formula C8H10FN3O3S
MDL Number MFCD00870151
Molecular Weight 247.247
MOL File 145416-34-8.mol
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Chemical Properties

Melting point  166-173°C
Boiling point  443.3±55.0 °C(Predicted)
density  1.82±0.1 g/cm3(Predicted)
storage temp.  Refrigerator
solubility  DMSO (Sparingly, Heated), Methanol (Slightly)
form  Solid
pka 13.83±0.10(Predicted)
color  Off-White to Light Beige
InChI InChI=1/C8H10FN3O3S/c9-4-1-12(8(14)11-7(4)10)5-3-16-6(2-13)15-5/h1,5-6,13H,2-3H2,(H2,10,11,14)/t5-,6-/s3
InChIKey XQSPYNMVSIKCOC-FJGCHTOXNA-N
SMILES C1(=O)N([C@H]2O[C@H](CO)SC2)C=C(F)C(N)=N1 |&1:3,5,r|

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