145918-75-8

Name TROXACITABINE
CAS 145918-75-8
EINECS(EC#) 200-258-5
Molecular Formula C8H11N3O4
MDL Number MFCD00871100
Molecular Weight 213.19
MOL File 145918-75-8.mol

Chemical Properties

Melting point  176-177°
alpha  D25 -38.33° (c = 0.43 in MeOH).
Boiling point  422.5±55.0 °C(Predicted)
density  1.71±0.1 g/cm3(Predicted)
storage temp.  Keep in dark place,Sealed in dry,2-8°C
solubility  DMSO (Slightly), Methanol (Slightly)
form  Solid
pka 14.83±0.10(Predicted)
color  White to Off-White
Stability: Hygroscopic
InChI InChI=1S/C8H11N3O4/c9-5-1-2-11(8(13)10-5)6-4-14-7(3-12)15-6/h1-2,6-7,12H,3-4H2,(H2,9,10,13)/t6-,7-/m0/s1
InChIKey RXRGZNYSEHTMHC-BQBZGAKWSA-N
SMILES C1(=O)N([C@@H]2CO[C@H](CO)O2)C=CC(N)=N1

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