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2',3'-Di-O-Acetyl-5'-Deoxy-5-Fluorocytidine

2',3'-DI-O-Acetyl-5'-Deoxy-5-Fluorocytidine / CAS : 161599-46-8

Appearance White to Almost white powder to crystal UN 0
HS 29349990 DG Class 0
Synonyms 5'-Deoxy-2',3'-di-O-Acetyl-5-Fluorocytidine; Cytidine, 5'-Deoxy-5-Fluoro-, 2',3'-Diacetate; [(2R,3R,4R,5R)-4-Acetyloxy-5-(4-Amino-5-Fluoro-2-Oxopyrimidin-1-yl)-2-Methyloxolan-3-yl] Acetate; 2,3-Di-O-Acetyl-5-Deoxy-5-Fuluro-D-Cytidine; 2,3-DI-O-Acetyl-5-Deoxy-5- Fluorocytidine
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Properties

Summary

Formula
C13H16FN3O6
Molecular Mass
329.28100
Exact Mass
329.10200
PSA
122.74000
Logp
0.32650
IUPAC
[(2R,3R,4R,5R)-4-acetyloxy-5-(4-amino-5-fluoro-2-oxopyrimidin-1-yl)-2-methyloxolan-3-yl] acetate
SMILES
C[C@@H]1[C@H]([C@H]([C@@H](O1)N2C=C(C(=NC2=O)N)F)OC(=O)C)OC(=O)C

Attribute classification

Matter Classification
organic
Category
API & Intermediate > Pharmaceutical Intermediates

Chemical and Physical Properties

Melting Point
196-198°C
Density
1.57±0.1 g/cm3(Predicted)
Boiling Point
427.4±55.0 °C(Predicted)
Appearance
White to Almost white powder to crystal
Acidity and Basicity
alkalinity

Export information

HS Code
29349990
Export Rebate
13%
UN No.
0
DG-Class
0

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