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4-Amino-1-(5-Deoxy-5-Iodo-2,3-O-Isopropylidenepentofuranosyl)-5-Fluoro-2(1H)-Pyrimidinone
[CAS# 61787-05-1]

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Identification
Name 4-Amino-1-(5-Deoxy-5-Iodo-2,3-O-Isopropylidenepentofuranosyl)-5-Fluoro-2(1H)-Pyrimidinone
Synonyms 5'-DEOXY-5-FLUORO-5'-IODO-2',3'-O-ISOPROPYLIDENECYTIDINE
Molecular Structure CAS#: 61787-05-1, 4-Amino-1-(5-Deoxy-5-Iodo-2,3-O-Isopropylidenepentofuranosyl)-5-Fluoro-2(1H)-Pyrimidinone
Molecular Formula C12H15FIN3O4
Molecular Weight 411.17
CAS Registry Number 61787-05-1
SMILES CC1(C)OC2C(O1)C(OC2N3/C=C(/F)\C(\N)=N/C3=O)CI
InChI 1S/C12H15FIN3O4/c1-12(2)20-7-6(3-14)19-10(8(7)21-12)17-4-5(13)9(15)16-11(17)18/h4,6-8,10H,3H2,1-2H3,(H2,15,16,18)
InChIKey ODAZHQCJQUGKRZ-UHFFFAOYSA-N
Properties
Density 2.125g/cm3 (Cal.)
Boiling point 462.779°C at 760 mmHg (Cal.)
Flash point 233.681°C (Cal.)
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