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4-Amino-1-[(2R,3R,4R,5R)-3-fluoro-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]pyrimidin-2-one Structure

4-Amino-1-[(2R,3R,4R,5R)-3-fluoro-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]pyrimidin-2-one

Chemical Properties

Melting point 167 °C
Boiling point 500.1±60.0 °C(Predicted)
Density  1.82±0.1 g/cm3(Predicted)
refractive index  80 ° (C=1, MeOH)
storage temp.  Keep in dark place,Sealed in dry,2-8°C
solubility  Soluble in DMSO, Methanol.
pka 12.84±0.70(Predicted)
form  Powder
color  White to Off-white
Water Solubility  Water: 5 mg/mL (20.39 mM; ultrasonic and warming and heat to 60°C)
InChI InChI=1S/C9H12FN3O4/c10-6-7(15)4(3-14)17-8(6)13-2-1-5(11)12-9(13)16/h1-2,4,6-8,14-15H,3H2,(H2,11,12,16)/t4-,6-,7-,8-/m1/s1
InChIKey NVZFZMCNALTPBY-XVFCMESISA-N
SMILES OC[C@H]1O[C@@H](N2C=CC(N)=NC2=O)[C@H](F)[C@@H]1O
CAS DataBase Reference 10212-20-1(CAS DataBase Reference)

Safety Information

Hazard Codes  Xi
Risk Statements  36/37/38
Safety Statements  26-36
HS Code  29389090

Usage And Synthesis

4-Amino-1-[(2R,3R,4R,5R)-3-fluoro-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]pyrimidin-2-one Supplier

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