3-FLUORO-2,3-DIDEOXYURIDINE

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Keyword(s): Human Metabolites
Molecule Category Free-form

Structure

InChI Key BKIUEHLYJFLWPK-SHYZEUOFSA-N
Smiles OC[C@H]1O[C@H](C[C@@H]1F)N2C=CC(=O)NC2=O
InChI
InChI=1S/C9H11FN2O4/c10-5-3-8(16-6(5)4-13)12-2-1-7(14)11-9(12)15/h1-2,5-6,8,13H,3-4H2,(H,11,14,15)/t5-,6+,8+/m0/s1

Physicochemical Descriptors

Property Name Value
Molecular Formula C9H11F1N2O4
Molecular Weight 230.07
AlogP -0.43
Hydrogen Bond Acceptor 6.0
Hydrogen Bond Donor 2.0
Number of Rotational Bond 2.0
Polar Surface Area 84.58
Heavy Atoms 16.0

Cross References

Resources Reference
CAS NUMBER 41107-56-6
NORMAN SUSDAT
CONTENTS