| Identification | More | [Name]
2',3'-Di-O-acetyl-5'-deoxy-5-fuluro-D-cytidine | [CAS]
161599-46-8 | [Synonyms]
2',3'-Di-O-acetyl-5'-deoxy-5-fluoro-D-cytidine
2,3-DI-O-ACETYL-5-DEOXY-5-FULURO-D-CYTIDINE
2',3'-Di-O-acetyl-5'-deoxy-5-fluoro-D-cytidine | [EINECS(EC#)]
2017-001-1 | [Molecular Formula]
C13H18FN3O6 | [MDL Number]
MFCD07369302 | [MOL File]
161599-46-8.mol | [Molecular Weight]
329.28 |
| Chemical Properties | Back Directory | [Melting point ]
196-198?C | [Boiling point ]
427.4±55.0 °C(Predicted) | [density ]
1.57±0.1 g/cm3(Predicted) | [storage temp. ]
-20°C Freezer | [solubility ]
soluble in Methanol | [form ]
powder to crystal | [pka]
2.49±0.10(Predicted) | [color ]
White to Almost white | [InChI]
InChI=1S/C13H16FN3O6/c1-5-9(22-6(2)18)10(23-7(3)19)12(21-5)17-4-8(14)11(15)16-13(17)20/h4-5,9-10,12H,1-3H3,(H2,15,16,20)/t5-,9-,10-,12-/m1/s1 | [InChIKey]
NWJBWNIUGNXJGO-YHHSPFQVSA-N | [SMILES]
C[C@H]1O[C@@H](N2C=C(F)C(N)=NC2=O)[C@H](OC(=O)C)[C@@H]1OC(=O)C | [CAS DataBase Reference]
161599-46-8(CAS DataBase Reference) |
| Hazard Information | Back Directory | [Chemical Properties]
White to Off-White Solid | [Uses]
A metabolite of Capecitabine. | [Uses]
Capecitabine intermediate | [Definition]
ChEBI: A member of the class of cytidines that is a metabolite of the drug capecitabine. |
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